UCSF

ZINC39846599

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 28 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) 3.20 9.56 -14.13 1 5 0 52 376.504 6
Mid Mid (pH 6-8) 3.20 11.78 -48.99 2 5 1 53 377.512 6

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