| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 15 | Yes |
Popular Name: Piperazine, 1-ethyl-4-(3-pyridinylmethyl)- (9CI) Piperazine, 1-ethyl-4-(3-pyridin…
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CAS Number: 414881-11-1
| 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) | 0.77 | 4.65 | -34.52 | 1 | 3 | 1 | 21 | 206.313 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 4.63 | -37.48 | 1 | 3 | 1 | 21 | 206.313 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 2.37 | -3.94 | 0 | 3 | 0 | 19 | 205.305 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.77 | 5.11 | -81.26 | 2 | 3 | 2 | 22 | 207.321 | 3 | ↓ |
