UCSF

ZINC39907591

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2010 35 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) 6.85 16.03 -15.29 0 5 0 46 472.629 11
Mid Mid (pH 6-8) 6.85 16.53 -39.09 1 5 1 47 473.637 11

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