UCSF

ZINC00257587

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 17th, 2005 17 Yes

Popular Name: 1-Cyclopentyl-1,3-benzodiazole-5-carboxylic acid 1-Cyclopentyl-1,3-benzodiazole-5…

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CAS Numbers: 702669-05-4 , [702669-05-4]

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) 2.78 8.74 -54.18 0 4 -1 58 229.259 2 ↓
Mid Mid (pH 6-8) 2.78 9.23 -55.8 1 4 0 59 230.267 2 ↓

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