UCSF

ZINC05334822

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2006 14 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) -1.25 -0.69 -8.44 2 5 0 71 193.206 3
Lo Low (pH 4.5-6) -1.25 -0.41 -35.86 3 5 1 72 194.214 3

Activity (Go SEA)

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