UCSF

ZINC04216375

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) 4.81 6.4 -8.56 1 4 0 59 330.472 0

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 2.77e-02 g/l DrugBank-Street Drugs
PUBCHEM_PATENT_ID EP0665009A1; EP0665009B1; EP0766963A1; EP0766963B1; EP0901368A1; US5811547; US5840741; WO1997029735A1; WO2000010540A1; WO2000020007A1; WO2000048636A1; WO2000066612A1; WO2000069445A1 IBM Patent Data

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.