| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 15 | Yes |
Popular Name: 7-Methoxy-4-oxo-1,4-dihydro-quinoline-3-carbonitrile 7-Methoxy-4-oxo-1,4-dihydro-quin…
| 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) | 1.72 | 2.63 | -37.79 | 0 | 4 | -1 | 69 | 199.189 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.42 | 4.04 | -19.23 | 1 | 4 | 0 | 66 | 200.197 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0973746A1; US6002008; WO1998043960A1; WO2000018740A1 | IBM Patent Data |
