UCSF

ZINC26474025

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 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) 2.02 6.84 -8.5 0 4 0 44 230.267 5
Lo Low (pH 4.5-6) 2.02 7.27 -40.01 1 4 1 45 231.275 5

Activity (Go SEA)

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