UCSF

ZINC02041344

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) -0.32 2.26 -34.41 1 4 1 46 340.509 9

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP1021204A2; EP1021435A1; US4824676; US5008111; US5656286; US6024976; US6136984; WO1986002272A1; WO1997040034A1; WO1998037078A1; WO1999015210A2; WO2000048636A1 IBM Patent Data

Activity (Go SEA)

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