UCSF

ZINC04538771

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) -1.96 -4.26 -18.58 4 8 0 122 320.386 13

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0028469A1; EP0038127A1; EP0521992A1; EP0521992B1; US4403003; US4539363; US5461089; US5635548; WO1994011446A1; WO1999030838A1; WO2000001774A1; WO2000001775A1; WO2000006637A1; WO2000022053A1; WO2000022054A1; WO2000053684A1; WO2000053685A1 IBM Patent Data

Activity (Go SEA)

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