| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2009 | 16 | Yes |
Popular Name: 7-(1-Piperazinyl)-isoquinoline Hydrochloride 7-(1-Piperazinyl)-isoquinoline H…
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CAS Number: 936643-78-6
| 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) | 1.42 | 3.86 | -48.63 | 2 | 3 | 1 | 33 | 214.292 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.42 | 2.45 | -5.8 | 1 | 3 | 0 | 28 | 213.284 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.42 | 4.31 | -87.07 | 3 | 3 | 2 | 34 | 215.3 | 1 | ↓ |
