| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2009 | 34 | Yes |
Popular Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-N-(2-morpholinoethyl)isoquinoline-7-carboxamide 1-[4-(4-fluorophenyl)piperazin-1…
| 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) | 3.07 | 8.45 | -14.39 | 1 | 7 | 0 | 61 | 463.557 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 10.71 | -51.72 | 2 | 7 | 1 | 62 | 464.565 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 8.92 | -44.64 | 2 | 7 | 1 | 62 | 464.565 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.07 | 11.2 | -92.26 | 3 | 7 | 2 | 63 | 465.573 | 6 | ↓ |
