UCSF

ZINC39134608

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2010 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) 0.27 -1.38 -7.94 3 3 0 59 144.199 1
Lo Low (pH 4.5-6) 0.27 -0.93 -27.15 4 3 1 60 145.207 1

Activity (Go SEA)

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