UCSF

ZINC05934749

Substance Information

In ZINC since Heavy atoms Benign functionality
February 19th, 2006 18 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) 2.91 1.8 -12.2 0 2 0 30 235.286 1
Lo Low (pH 4.5-6) 2.91 1.32 -26.99 1 2 1 31 236.294 1

Activity (Go SEA)

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