UCSF

ZINC05345129

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2006 17 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) 0.24 -1.53 -14.76 3 8 0 124 239.187 3
Hi High (pH 8-9.5) 0.24 -0.97 -52.98 2 8 -1 127 238.179 3

Activity (Go SEA)

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