UCSF

ZINC00000282

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) 5.75 13.18 -41.48 1 2 1 9 327.517 5

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP1021204A2; EP1030659A1; US5446070; US5719197; US6024976; WO1996040086A2; WO1998000168A1; WO1998001134A1; WO1999015210A2; WO2000048636A1; WO2000074661A2 IBM Patent Data

Activity (Go SEA)

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