UCSF

ZINC38220178

Substance Information

In ZINC since Heavy atoms Benign functionality
January 12th, 2010 10 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) 1.12 3.03 -15.6 1 3 0 46 138.17 3
Ref Reference (pH 7) 1.12 2.96 -9.21 1 3 0 46 138.17 3

Activity (Go SEA)

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