UCSF

ZINC40448832

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2010 24 No

Popular Name: 7-Amino-3-chloromethyl-3-cephem-4-carboxylic acid p-methoxybenzyl ester hydrochloride 7-Amino-3-chloromethyl-3-cephem-…

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CAS Number: 113479-65-5

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) 1.43 5.75 -17.11 2 6 0 82 368.842 6 ↓
Mid Mid (pH 6-8) 1.43 6.05 -57.37 3 6 1 83 369.85 6 ↓

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