UCSF

ZINC25407183

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2009 18 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) -1.20 -1.43 -20.51 4 7 0 114 270.314 5

Activity (Go SEA)

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