In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 12 | Yes |
None
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) | 0.76 | 1.86 | -8.54 | 1 | 4 | 0 | 42 | 170.212 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0392317A2; EP0392317B1; US5541229; US5864043; US6153754; WO1997023213A1 | IBM Patent Data |