UCSF

ZINC40187743

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 32 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) 4.07 11.84 -17.96 1 7 0 76 434.54 6
Mid Mid (pH 6-8) 4.07 12.19 -35.82 2 7 1 78 435.548 6

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