UCSF

ZINC05942733

Substance Information

In ZINC since Heavy atoms Benign functionality
February 19th, 2006 26 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) 2.11 2.64 -64.3 1 9 -1 144 376.37 5
Lo Low (pH 4.5-6) 2.11 1.87 -30.6 2 9 0 142 377.378 5

Activity (Go SEA)

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