UCSF

ZINC34669727

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 16 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) 1.59 -1.66 -11.21 1 9 0 150 244.188 3
Mid Mid (pH 6-8) 1.59 -0.67 -37.77 0 9 -1 153 243.18 3

Activity (Go SEA)

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