UCSF

ZINC34145215

Substance Information

In ZINC since Heavy atoms Benign functionality
August 11th, 2009 22 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) 1.13 5.38 -16.5 0 6 0 58 320.418 2
Mid Mid (pH 6-8) 1.13 7.74 -52.84 1 6 1 60 321.426 2

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