UCSF

ZINC05199225

Substance Information

In ZINC since Heavy atoms Benign functionality
January 25th, 2006 20 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) 2.09 3.89 -17.3 1 7 0 97 273.248 4
Lo Low (pH 4.5-6) 2.09 4.61 -47.94 2 7 1 98 274.256 4

Activity (Go SEA)

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