In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2011 | 14 | No |
None
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) | -2.65 | 1.52 | -76.19 | 8 | 6 | 1 | 131 | 203.266 | 7 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0196841A1; EP0592557A1; EP0592557B1; EP0597831A1; EP0597831B1; EP0669824A1; EP0669824B1; EP0922454A2; EP1046392A2; US5028627 | IBM Patent Data |