UCSF

ZINC28833341

Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2009 26 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) 1.25 7.56 -9.58 0 6 0 54 349.438 3
Mid Mid (pH 6-8) 1.25 9.9 -52.66 1 6 1 55 350.446 3

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