In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2010 | 13 | Yes |
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) | 3.84 | 7.37 | -3.03 | 0 | 1 | 0 | 9 | 176.259 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0499266B1; EP0547317A1; EP0626174A2; EP0626174A3; US5306808; US5352659; US6147051; WO1991013089A1 | IBM Patent Data |