UCSF

ZINC11904734

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2008 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) 2.71 -5.55 -22.39 0 7 0 92 436.555 6

Activity (Go SEA)

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