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BPI-16350
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
chemical structure
BPI-16350.svg
1,155 × 380; 34 KB
0 references
mass
518.2717994640001
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₃₂F₂N₈
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCN1CCN(Cc2ccc(Nc3ncc(F)c(-c4cc(F)c5nc6n(c5c4)C(C)CCC6)n3)nc2)CC1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C28H32F2N8/c1-3-36-9-11-37(12-10-36)17-19-7-8-24(31-15-19)33-28-32-16-22(30)26(35-28)20-13-21(29)27-23(14-20)38-18(2)5-4-6-25(38)34-27/h7-8,13-16,18H,3-6,9-12,17H2,1-2H3,(H,31,32,33,35)
0 references
InChIKey
XOJPAVACYRFOBK-UHFFFAOYSA-N
0 references
PubChem CID
135181567
1 reference
matched by identifier from
InChIKey
InChIKey
XOJPAVACYRFOBK-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL20332436
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XOJPAVACYRFOBK-UHFFFAOYSA-N
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BPI-16350
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