UCSF

ZINC33678195

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2009 30 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) 8.27 14.23 -8.08 0 3 0 34 453.394 3
Ref Reference (pH 7) 8.27 15.5 -8.4 0 3 0 34 453.394 3

Activity (Go SEA)

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