UCSF

ZINC06026848

Substance Information

In ZINC since Heavy atoms Benign functionality
March 1st, 2006 14 Yes

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) -1.48 3.44 -33.31 3 4 0 81 194.234 4
Lo Low (pH 4.5-6) -1.48 3.72 -80.09 4 4 1 82 195.242 4

Activity (Go SEA)

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