In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2005 | 15 | 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) | -3.08 | -10.64 | -14.85 | 5 | 7 | 0 | 119 | 221.209 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0576592A1; EP0576592B1; US5461143; US5593887; US5759823; WO1992016640A1 | IBM Patent Data |