UCSF

ZINC35775766

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2009 11 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) 0.35 -0.35 -5.09 0 3 0 25 157.213 2
Mid Mid (pH 6-8) 0.35 1.87 -34.78 1 3 1 26 158.221 2

Activity (Go SEA)

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