UCSF

ZINC09034011

Substance Information

In ZINC since Heavy atoms Benign functionality
August 5th, 2007 29 Yes

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) 0.66 -11.78 -22.52 6 10 0 159 423.426 5

Activity (Go SEA)

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