UCSF

ZINC25490051

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2009 8 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) -0.84 1.53 -89.69 1 3 -2 52 149.196 3
Lo Low (pH 4.5-6) -0.84 1.06 -41.1 1 3 -1 52 150.204 3

Activity (Go SEA)

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