UCSF

ZINC00151360

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 19 Yes

Popular Name: benzoic acid, 3-[(phenylacetyl)amino]- benzoic acid, 3-[(phenylacetyl)a…

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CAS Numbers: , 73548-13-7

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) 2.81 0.01 -52.89 1 4 -1 69 254.265 4 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID WO2000001692A1 IBM Patent Data

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Analogs ( Draw Identity 99% 90% 80% 70% )