In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 25th, 2010 | 10 | 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) | 1.96 | 3.79 | -34.35 | 3 | 1 | 1 | 28 | 221.143 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0758897A1; EP1006115A2; EP1006115A3; US5364862; US5561134; US5652366; US5736554; WO1992005177A1; WO1995028160A1; WO1997024327A1 | IBM Patent Data |