In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 6th, 2006 | 8 | 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) | 1.04 | 1.79 | -7.3 | 1 | 2 | 0 | 29 | 115.176 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0777658A1; EP0777658B1; EP0958292A1; US5885934; US6165944; WO1998031682A1 | IBM Patent Data |