UCSF

ZINC39917650

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 26 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) 4.81 14.97 -46.48 1 3 1 22 348.514 8
Mid Mid (pH 6-8) 4.81 15.27 -97.45 2 3 2 24 349.522 8

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