UCSF

ZINC34627948

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 15 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) -1.05 -1.79 -38.09 6 6 0 120 212.205 3
Hi High (pH 8-9.5) -1.05 -1.69 -49.01 5 6 -1 119 211.197 3

Activity (Go SEA)

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