UCSF

ZINC38531562

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) -1.80 0.9 -55.82 2 6 -1 99 218.229 5

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0862464A1; US5808146; US5817776; WO1997017092A1 IBM Patent Data
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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