UCSF

ZINC33708794

Substance Information

In ZINC since Heavy atoms Benign functionality
July 16th, 2009 32 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) 6.37 14.02 -13.15 0 5 0 53 444.556 6
Ref Reference (pH 7) 6.37 12.87 -12.83 0 5 0 53 444.556 6

Activity (Go SEA)

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