| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 12 | Yes |
Popular Name: N*1*-Methyl-N*1*-pyridin-3-ylmethyl-ethane-1,2-diamine N*1*-Methyl-N*1*-pyridin-3-ylmet…
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CAS Number: 50331-69-6
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| 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) | -0.69 | 2.65 | -120.36 | 4 | 3 | 2 | 45 | 167.256 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.69 | 0.3 | -45.45 | 3 | 3 | 1 | 44 | 166.248 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.69 | 0.77 | -86.69 | 4 | 3 | 2 | 45 | 167.256 | 4 | ↓ |
