UCSF

ZINC04460877

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2005 24 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) 5.03 7.84 -9.86 1 4 0 55 338.432 3
Ref Reference (pH 7) 5.03 8.37 -9.61 1 4 0 55 338.432 3

Activity (Go SEA)

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