UCSF

ZINC30731493

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2009 27 No

CAS Number: 1172-63-0

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) 4.73 13.45 -10.01 0 5 0 70 374.477 9

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