UCSF

ZINC26513844

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 13 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) -0.91 -0.44 -63.97 3 5 1 88 210.275 6
Mid Mid (pH 6-8) -0.91 -0.76 -19.35 2 5 0 86 209.267 6

Activity (Go SEA)

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