| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2008 | 31 | Yes |
Popular Name: 2-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propylamino]quinoline-4-carboxylic 2-[3-[4-(4-methoxyphenyl)piperaz…
| 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) | 3.89 | 9.54 | -104.79 | 3 | 7 | 1 | 83 | 421.521 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.89 | 6.79 | -53.23 | 1 | 7 | -1 | 81 | 419.505 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.89 | 9.1 | -78.21 | 2 | 7 | 0 | 82 | 420.513 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.89 | 7.23 | -54.23 | 2 | 7 | 0 | 82 | 420.513 | 8 | ↓ |
