UCSF

ZINC03977940

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) 1.12 3.13 -57.46 3 5 1 71 328.388 2
Hi High (pH 8-9.5) 1.12 1.42 -17.09 2 5 0 70 327.38 2

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0144341A1; EP0170090A1; EP0238507A1; EP0250796A2; US4089855; US4496570; US4619936; US4668685; US4673679; US4722928; US4760069; US4912109; US4916142; US4954506; US4990617; US5071985; US5760044; US5866154; US5965567; WO1999003347A1 IBM Patent Data
Therapy narcotic antagonist SMDC MicroSource

Activity (Go SEA)

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