UCSF

ZINC05719152

Substance Information

In ZINC since Heavy atoms Benign functionality
February 10th, 2006 8 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) 2.07 0.24 -1.59 0 1 0 9 114.188 1

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0035046A1; EP0278311A1; EP0355544A2; EP0355544B1; EP0364797B1; EP0450066A1; EP0450066B1; EP0569592A1; US4198429; US4435404; US4540703; US4663323; US4761486; US4766120; US4894385; US4948415; US5006148; US5069711; US5108483; US5187286; US5216167; US522131 IBM Patent Data

Activity (Go SEA)

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