| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 17 | Yes |
Popular Name: 2-{1-[5-(aminomethyl)pyridin-2-yl]piperidin-2-yl}ethan-1-ol 2-{1-[5-(aminomethyl)pyridin-2-y…
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CAS Number: 954572-56-6
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) | 0.86 | 1.36 | -108.94 | 5 | 4 | 2 | 65 | 237.347 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 0.97 | -28.81 | 4 | 4 | 1 | 64 | 236.339 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 0.7 | -8.36 | 3 | 4 | 0 | 62 | 235.331 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.86 | 1.1 | -51.57 | 4 | 4 | 1 | 64 | 236.339 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
