UCSF

ZINC34612452

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 15 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 0.75 7.79 -39.08 1 3 1 31 212.313 2
Hi High (pH 8-9.5) 0.75 6.15 -6.67 0 3 0 30 211.305 2

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