UCSF

ZINC07696655

Substance Information

In ZINC since Heavy atoms Benign functionality
June 12th, 2006 21 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 3.80 7.87 -39.52 2 4 1 43 358.3 8
Mid Mid (pH 6-8) 3.80 5.6 -9.4 1 4 0 42 357.292 8

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