UCSF

ZINC52240981

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2010 22 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 1.06 5.59 -8.4 0 5 0 46 306.406 3
Mid Mid (pH 6-8) 1.06 7.78 -42.14 1 5 1 47 307.414 3

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