In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2008 | 18 | No |
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) | -2.17 | -7.25 | -24.12 | 6 | 9 | 0 | 143 | 258.234 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0948256A1; WO1995010629A1; WO1998018324A1 | IBM Patent Data |