UCSF

ZINC02015819

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) 1.96 1.14 -51.06 1 4 1 33 287.383 4

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP1003501A1; EP1054998A1; US5795909; US6040147; WO1997044063A2; WO1998043630A1; WO1999001089A1; WO1999015629A1; WO1999030690A1; WO1999036570A2; WO2000027999A2; WO2000040604A2; WO2000050020A2; WO2000059490A2; WO2000059941A1 IBM Patent Data

Activity (Go SEA)

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