UCSF

ZINC27910595

Substance Information

In ZINC since Heavy atoms Benign functionality
February 21st, 2009 23 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) 0.72 4.92 -47.94 3 6 1 74 338.453 5
Hi High (pH 8-9.5) 0.72 2.38 -17.89 2 6 0 73 337.445 5

Activity (Go SEA)

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