UCSF

ZINC32117951

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 18 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) 1.90 7.68 -49.29 0 4 -1 60 268.72 6
Lo Low (pH 4.5-6) 1.90 6.56 -10.31 1 4 0 58 269.728 6

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