| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2008 | 21 | Yes |
Popular Name: 2-(4-Benzylpiperazin-1-yl)isonicotinonitrile 2-(4-Benzylpiperazin-1-yl)isonic…
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CAS Number: 1016862-98-8
None
| 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) | 2.14 | 9.06 | -43.11 | 1 | 4 | 1 | 44 | 279.367 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.14 | 6.74 | -6.29 | 0 | 4 | 0 | 43 | 278.359 | 3 | ↓ |
