UCSF

ZINC00188410

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 20 Yes

Popular Name: 2-Oxo-2H-1-benzopyran-3-carboxylic acid phenyl ester; 2H-1-Benzopyran-3-carboxylic acid, 2-oxo-, phenyl ester; BRN 0224490; LS-39242; Phenyl coumarin-3-carboxylate 2-Oxo-2H-1-benzopyran-3-carboxyl…

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Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.47 10.31 -15.09 0 4 0 57 266.252 3 ↓

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