UCSF

ZINC40183339

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 36 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) 5.09 15.83 -16.91 0 6 0 57 487.644 11
Mid Mid (pH 6-8) 5.09 16.34 -42.43 1 6 1 58 488.652 11

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