UCSF

ZINC34875243

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 25 No

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) 3.65 9.96 -44.39 2 4 1 44 452.312 7
Hi High (pH 8-9.5) 3.65 8.59 -8.12 1 4 0 40 451.304 7

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