In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2004 | 17 | 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) | 3.96 | 3.02 | -6.9 | 0 | 3 | 0 | 43 | 234.295 | 8 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0180188A2; EP0180188B1; EP0180897A2; EP0180897B1; EP0323441A2; EP0323441B1; EP0436902A1; EP0436902B1; US4864021; US4983609; US5155113 | IBM Patent Data |