In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 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) | 0.85 | 0.62 | -7.22 | 2 | 3 | 0 | 50 | 182.219 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0634408A1; US5514773 | IBM Patent Data |
PUBCHEM_PATENT_ID | US5559214; US5760191; US5817774; WO1999039748A1 | IBM Patent Data |