UCSF

ZINC32801941

Substance Information

In ZINC since Heavy atoms Benign functionality
May 10th, 2009 24 No

Download: MOL2 SDF SMILES Flexibase

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) 0.84 5.14 -55.17 3 7 1 83 339.46 7
Hi High (pH 8-9.5) 0.84 2.89 -24.06 2 7 0 82 338.452 7

Activity (Go SEA)

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