UCSF

ZINC05395391

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2006 9 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) 1.43 4.47 -45.46 0 2 -1 40 147.219 5
Hi High (pH 8-9.5) 1.43 5.01 -98.37 0 2 -2 40 146.211 5

Activity (Go SEA)

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