In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 15 | Yes |
Popular Name: 2-(4-(Pyridin-2-yl)piperazin-1-yl)ethanamine 2-(4-(Pyridin-2-yl)piperazin-1-y…
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CAS Numbers: 30194-54-8 , [30194-54-8]
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) | -0.16 | 0.86 | -84.89 | 4 | 4 | 2 | 48 | 208.309 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.16 | 0.58 | -48.86 | 3 | 4 | 1 | 47 | 207.301 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.16 | 4.22 | -121.27 | 4 | 4 | 2 | 48 | 208.309 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.16 | 4.54 | -185.51 | 5 | 4 | 3 | 49 | 209.317 | 3 | ↓ |