UCSF

ZINC33969757

Substance Information

In ZINC since Heavy atoms Benign functionality
August 5th, 2009 29 No

CAS Number: 427-51-0

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) 4.44 12.22 -18.85 0 4 0 60 416.945 3

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