UCSF

ZINC40191704

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 30 Yes

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 5.17 13.86 -9.3 1 4 0 47 397.522 8
Mid Mid (pH 6-8) 5.17 14.41 -32.86 2 4 1 48 398.53 8

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