| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2011 | 13 | Yes |
Popular Name: (2S)-N2-methyl-N1-(2-pyridylmethyl)propane-1,2-diamine (2S)-N2-methyl-N1-(2-pyridylmeth…
| 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) | 0.44 | 3.54 | -113.27 | 4 | 3 | 2 | 46 | 181.283 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.44 | 2.2 | -37.72 | 3 | 3 | 1 | 42 | 180.275 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.44 | 2.15 | -34.08 | 3 | 3 | 1 | 42 | 180.275 | 5 | ↓ |
