In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 7 | 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) | 1.52 | 2.23 | -1.51 | 1 | 1 | 0 | 20 | 100.161 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0718280A2; EP0718280A3; EP0843967A1; EP0843967B1; US5227381; US5401740; US5856311 | IBM Patent Data |