| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 16 | Yes |
Popular Name: 3-Pyridinamine,N-(1-methylethyl)-2-(1-piperazinyl)- 3-Pyridinamine,N-(1-methylethyl)…
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CAS Number: 147539-21-7
3-Pyridinamine, N-(1-methylethyl)-2-(1-piperazinyl)-
3-Pyridylamine, N-(1-methylethyl)-2-(1-piperazinyl)-, ; Dihydrochloride Monohydrate
| 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) | 1.59 | 3.85 | -93.72 | 4 | 4 | 2 | 46 | 222.336 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.59 | 2.44 | -25.89 | 3 | 4 | 1 | 41 | 221.328 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.59 | 3.51 | -42.64 | 3 | 4 | 1 | 45 | 221.328 | 3 | ↓ |
