(Q52360200)

30 April 2018

title

Atom/fragment contribution method for estimating octanol-water partition coefficients (English)

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30 April 2018

author name string

W M Meylan

series ordinal

1

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30 April 2018

P H Howard

series ordinal

2

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language of work or name

English

0 references

publication date

1 January 1995

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30 April 2018

Journal of Pharmaceutical Sciences

published in

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30 April 2018

volume

84

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30 April 2018

issue

1

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page(s)

83-92

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30 April 2018

SMILES, a chemical language and information system. 1. Introduction to methodology and encoding rules

cites work

1 reference

COCI

https://opencitations.net/index/coci/api/v1/citations/10.1021/CI00057A005

Atomic physicochemical parameters for three dimensional structure directed quantitative structure-activity relationships. 4. Additional parameters for hydrophobic and dispersive interactions and their application for an automated superposition of ...

11 September 2021

1 reference

COCI

https://opencitations.net/index/coci/api/v1/citations/10.1021/CI00063A006

Computer estimation of the Atmospheric gas-phase reaction rate of organic compounds with hydroxyl radicals and ozone

12 September 2021

1 reference

27 May 2022

https://opencitations.net/index/coci/api/v1/references/10.1002/JPS.2600840120

An extended version of a novel method for the estimation of partition coefficients

1 reference

27 May 2022

https://opencitations.net/index/coci/api/v1/references/10.1002/JPS.2600840120

Atomic Physicochemical Parameters for Three-Dimensional Structure-Directed Quantitative Structure-Activity Relationships I. Partition Coefficients as a Measure of Hydrophobicity

1 reference

27 May 2022

https://opencitations.net/index/coci/api/v1/references/10.1002/JPS.2600840120

Prediction of octanol/water partition coefficients using parameters derived from molecular structures

1 reference

27 May 2022

https://opencitations.net/index/coci/api/v1/references/10.1002/JPS.2600840120

Group contribution method for predicting probability and rate of aerobic biodegradation

1 reference

27 May 2022

https://opencitations.net/index/coci/api/v1/references/10.1002/JPS.2600840120

Improved estimation of solubility and partitioning through correction of UNIFAC-derived activity coefficients

1 reference

27 May 2022

https://opencitations.net/index/coci/api/v1/references/10.1002/JPS.2600840120

Identifiers

DOI

10.1002/JPS.2600840120

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30 April 2018

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30 April 2018