UCSF

ZINC58638434

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2011 17 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) -2.83 -5.38 -209.95 3 10 -3 182 271.094 4
Mid Mid (pH 6-8) -2.83 -6.54 -102.3 4 10 -2 180 272.102 4

Activity (Go SEA)

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