UCSF

ZINC00405158

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) -1.89 -2.31 -41.02 3 3 0 67 129.159 3

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 97% Fluorochem
PUBCHEM_PATENT_ID EP0684240A1; EP0684240B1; EP0763013A1; EP0832074A1; US5614508; US5614625; US5698690; US5710167; US5731441; US6015800; US6063774; US6066662; US6096744; US6147051; WO1992020706A1; WO1993021219A1; WO1994014843A1; WO1995033709A1; WO1997046539A1; WO1998023599A IBM Patent Data

Activity (Go SEA)

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