(Q52238446)

27 April 2018

title

Prediction of human intestinal absorption of drug compounds from molecular structure (English)

1 reference

27 April 2018

Prediction of Human Intestinal Absorption of Drug Compounds from Molecular Structure (English)

1 reference

3 January 2025

main subject

molecular geometry

0 references

intestinal absorption

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?resulttype=core&format=json&query=SRC%3AMED%20AND%20EXT_ID%3A9691477

3 January 2025

author name string

M. D. Wessel

1

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?resulttype=core&format=json&query=SRC%3AMED%20AND%20EXT_ID%3A9691477

3 January 2025

P. C. Jurs

2

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?resulttype=core&format=json&query=SRC%3AMED%20AND%20EXT_ID%3A9691477

3 January 2025

J. W. Tolan

3

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?resulttype=core&format=json&query=SRC%3AMED%20AND%20EXT_ID%3A9691477

3 January 2025

S. M. Muskal

4

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?resulttype=core&format=json&query=SRC%3AMED%20AND%20EXT_ID%3A9691477

3 January 2025

publication date

1 July 1998

1 reference

27 April 2018

July 1998

1 reference

National Center for Biotechnology Information

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/esummary.fcgi?db=pubmed&retmode=json&id=9691477

3 January 2025

language of work or name

English

1 reference

National Center for Biotechnology Information

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/esummary.fcgi?db=pubmed&retmode=json&id=9691477

full work available at URL

3 January 2025

https://pubs.acs.org/doi/pdf/10.1021/ci980029a

1 reference

Journal of Chemical Information and Computer Sciences

3 January 2025

published in

0 references

volume

38

1 reference

27 April 2018

issue

4

1 reference

27 April 2018

page(s)

726-735

1 reference

27 April 2018

Graph theory and group contributions in the estimation of boiling points

cites work

2 references

7 December 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI00022A004

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Predicting blood-brain transport of drugs: a computational approach

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Norfloxacin. A review of its antibacterial activity, pharmacokinetic properties and therapeutic use.

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Absorption, metabolism, and excretion of oral testosterone in humans by mass fragmentography

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

The clinical pharmacology of methotrexate.new applications of an old drug

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Angiotensin-converting enzyme (ACE) inhibitor transport in human intestinal epithelial (Caco-2) cells

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Pharmacokinetics of amoxicillin: dose dependence after intravenous, oral, and intramuscular administration

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Cephalexin: Pharmacologic Evaluation Following Oral and Parenteral Administration

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Evaluation of physicochemical parameters important to the oral bioavailability of peptide-like compounds: implications for the synthesis of renin inhibitors

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Age, disease, and cimetidine disposition in healthy subjects and chronically ill patients

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Relative lipophilicities and structural-pharmacological considerations of various angiotensin-converting enzyme (ACE) inhibitors

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Pharmacokinetic comparison of pindolol with other beta-adrenoceptor-blocking agents

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Pharmacokinetics and Bioavailability of Ranitidine in Humans

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Dose-dependent pharmacokinetic study of pefloxacin, a new antibacterial agent, in humans

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Review of the bioavailability and pharmacokinetics of oral norfloxacin

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Tolerability and well-being with metoprolol in a controlled release (CR/ZOK) formulation: a review article

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Absorption potential: estimating the fraction absorbed for orally administered compounds

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Correlation of Biological Activity of Phenoxyacetic Acids with Hammett Substituent Constants and Partition Coefficients

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

The Clinical Pharmacology, Pharmacokinetics and Metabolism of Sumatriptan

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

A correlation between the permeability characteristics of a series of peptides using an in vitro cell culture model (Caco-2) and those using an in situ perfused rat ileum model of the intestinal mucosa

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Predicting fraction dose absorbed in humans using a macroscopic mass balance approach

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Comparison of intestinal permeabilities determined in multiple in vitro and in situ models: relationship to absorption in humans

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Single and multiple dose pharmacokinetics of tenidap sodium in healthy subjects

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Estimating human oral fraction dose absorbed: a correlation using rat intestinal membrane permeability for passive and carrier-mediated compounds

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Pharmacokinetics and concentration-effect relationships of intervenous and oral clonidine

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Clinical pharmacokinetics of clonidine

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

The Gastrointestinal Absorption of Atropine in Man

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Comparison of the permeability characteristics of a human colonic epithelial (Caco-2) cell line to colon of rabbit, monkey, and dog intestine and human drug absorption

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

A saturable transport mechanism in the intestinal absorption of gabapentin is the underlying cause of the lack of proportionality between increasing dose and drug levels in plasma

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Pharmacokinetics of hydrochlorothiazide in man

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Fate of [14C]-bumetanide in man

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Disposition of captopril in normal subjects

1 reference

7 December 2024

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Quantitative structure-metabolism relationships for substituted benzoic acids in the rabbit: prediction of urinary excretion of glycine and glucuronide conjugates

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Correlation of drug absorption with molecular surface properties

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Effect of dose on phenytoin absorption

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Applications of neural networks in quantitative structure-activity relationships of dihydrofolate reductase inhibitors

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Unified model for the corneal permeability of related and diverse compounds with respect to their physicochemical properties

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Absorption and decomposition of potassium-35S-phenoxymethyl penicillin

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Cefuroxime - a new cephalosporin antibiotic

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Distinguishing Atom Differences in a Molecular Graph Shape Index

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Pharmacokinetics of terazosin

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Clinical Pharmacokinetics of Diazepam

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Pharmacokinetics/pharmacodynamics of furosemide in man: A review

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Applications of combinatorial technologies to drug discovery. 2. Combinatorial organic synthesis, library screening strategies, and future directions

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Pharmacokinetics of acrivastine after oral and colonic administration

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Clinical pharmacokinetics of zidovudine. An update

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Pharmacokinetics and bioavailability of sodium valproate

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

The absolute bioavailability of caffeine in man

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Clinical pharmacokinetics of new antiepileptic drugs

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

The clinical importance of cardioselectivity and lipophilicity in beta blockers.

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Valproic acid. Review of a new antiepileptic drug

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Clinical pharmacokinetics of ketoprofen and its enantiomers

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Bioavailability and reversible metabolism of prednisone and prednisolone in man

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Small intestinal permeability to mannitol, lactulose, and polyethylene glycol 400 in celiac disease

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Prediction of Reduced Ion Mobility Constants of Organic Compounds from Molecular Structure

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Clinical pharmacokinetics of sotalol

1 reference

7 December 2024

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Application of neural networks: quantitative structure-activity relationships of the derivatives of 2,4-diamino-5-(substituted-benzyl)pyrimidines as DHFR inhibitors

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

The pharmacokinetics of olsalazine sodium in healthy volunteers after a single i.v. dose and after oral doses with and without food

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Chance factors in studies of quantitative structure-activity relationships

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Correlation between oral drug absorption in humans and apparent drug permeability coefficients in human intestinal epithelial (Caco-2) cells

1 reference

7 December 2024

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Understanding and using genetic algorithms Part 1. Concepts, properties and context

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Human pharmacokinetics and tolerance of oral ganciclovir

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Simultaneous in vitro measurement of intestinal tissue permeability and transepithelial electrical resistance (TEER) using Sweetana-Grass diffusion cells

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Estimate of volume/flow ratio of gastrointestinal (GI) fluids in humans using pharmacokinetic data

1 reference

7 December 2024

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Pharmacokinetic and pharmacodynamic studies of felodipine in healthy subjects after various single, oral and intravenous doses.

1 reference

7 December 2024

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Clinical pharmacokinetics of imipramine and desipramine

1 reference

7 December 2024

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van der Waals Volumes and Radii

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Clinical Pharmacokinetics of Chloramphenicol and Chloramphenicol Succinate

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Intestinal drug absorption during induced net water absorption in man; a mechanistic study using antipyrine, atenolol and enalaprilat

1 reference

7 December 2024

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Betaxolol: a new long-acting beta 1-selective adrenergic blocker

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Kinetics and biotransformation of lormetazepam. II. Radioimmunologic determinations in plasma and urine of young and elderly subjects: first-pass effect

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

The physiological disposition and metabolic fate of hydrocortisone in man.

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Lisinopril: a new angiotensin-converting enzyme inhibitor

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Flux measurements across Caco-2 monolayers may predict transport in human large intestinal tissue

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Felodipine kinetics in healthy men.

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Bioavailability of chlorothiazide from 50, 100, and 250 MG solution doses

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

In vitro permeability through caco-2 cells is not quantitatively predictive of in vivo absorption for peptide-like drugs absorbed via the dipeptide transporter system

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Gastrointestinal absorption of quinidine from some solutions and commercial tablets

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Absorption of polar drugs following caecal instillation in healthy volunteers

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Clinical pharmacokinetics of newer antiepileptic drugs. Lamotrigine, vigabatrin, gabapentin and oxcarbazepine

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Ondansetron Clinical Pharmacokinetics

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Human pharmacokinetics of sotalol.

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Quantitative structure-pharmacokinetic relationships (QSPR) of beta blockers derived using neural networks

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Hydrogen bonding. 33. Factors that influence the distribution of solutes between blood and brain

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Stereoselective disposition of ibuprofen enantiomers in man

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Human intravenous pharmacokinetics and absolute oral bioavailability of cefatrizine

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Structural Determination of Paraffin Boiling Points

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Pharmacokinetics of fluvastatin after single and multiple doses in normal volunteers

1 reference

7 December 2024

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Statistics using neural networks: chance effects.

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Clinical pharmacokinetics and pharmacodynamics of warfarin. Understanding the dose-effect relationship.

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Clinical pharmacokinetics of valproic acid

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Quantitative structure--pharmacokinetic relationship of a series of sulfonamides in the rat.

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Disposition of pravastatin sodium, a tissue-selective HMG-CoA reductase inhibitor, in healthy subjects

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Effect of dose and food on the bioavailability of cefuroxime axetil

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

The absorption of doxorubicin and mitomycin C in perioperative instillation. An experimental and clinical study

1 reference

7 December 2024

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Mechanism and kinetics of transcellular transport of a new beta-lactam antibiotic loracarbef across an intestinal epithelial membrane model system (Caco-2)

1 reference

7 December 2024

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Absorption of steroid hormones from the human small intestine

1 reference

7 December 2024

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Pharmacokinetic studies of practolol, a beta adrenergic antagonist, in man

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

A predictive algorithm for skin permeability: the effects of molecular size and hydrogen bond activity

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

The clinical pharmacology of etoposide and teniposide

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Applications of combinatorial technologies to drug discovery. 1. Background and peptide combinatorial libraries

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Gender-based effects on methylprednisolone pharmacokinetics and pharmacodynamics

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Preliminary observations on the excretion of acebutolol and its acetyl metabolite in the urine and faeces of man

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

The absorption, excretion and metabolism of disodium (14C)cromoglycate in man

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

Bioavailability of cefuroxime axetil: comparison of standard and abbreviated methods

1 reference

7 December 2024

https://opencitations.net/index/api/v1/references/10.1021/CI980029A

13

63

4243

Wessel M. D.

1996

1 reference

Journal of Medicinal Chemistry

3 January 2025

20

38

1455

Hamilton H. W.

1995

1 reference

Journal of Pharmaceutical Sciences

3 January 2025

22

83

1268

Abraham M. H.

1994

1 reference

Journal of the American Chemical Society

3 January 2025

32

59

103

Hammet L. P

1937

1 reference

Accounts of Chemical Research

3 January 2025

35

2

153

Hansch C

1993

1 reference

Drug Metabolism and Disposition

3 January 2025

56

21

769

Dixon C. M.

1993

1 reference

Pharmacology & Therapeutics

3 January 2025

61

6

706

Riley S. A.

1992

1 reference

Clinical Pharmacology & Therapeutics

3 January 2025

87

54

414

Lew K. H.

1993

1 reference

American Journal of Medicine

3 January 2025

101

93

195

DeSante K. A.

1992

1 reference

Acta pharmaceutica Suecica

3 January 2025

107

8

70

Johansson R.

1971

1 reference

Journal of Pharmacology and Experimental Therapeutics

3 January 2025

115

96

459

Glazko J.

1949

1 reference

British Journal of Clinical Pharmacology

3 January 2025

127

19

674

Lee E. J. D.

1985

1 reference

3 January 2025

Cancer Treatment Reports

129

65

54

Chabner B. A.

1981

1 reference

3 January 2025

131

25

1024

Henderson E. S.

1965

1 reference

3 January 2025

Pharmacological Reviews

132

14

135

Delmonte L.

1962

1 reference

3 January 2025

Identifiers

DOI

10.1021/CI980029A

1 reference

27 April 2018

journals/jcisd/WesselJTM98

DBLP publication ID

1 reference

DBLP Dataset 2021-01-02

28 January 2021

1 reference

27 April 2018