| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 16 | Yes |
Popular Name: (2R,3S)-N1,3-dimethyl-N1-(2-pyridylmethyl)pentane-1,2-diamine (2R,3S)-N1,3-dimethyl-N1-(2-pyri…
| 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) | 1.06 | 3.6 | -35.42 | 3 | 3 | 1 | 44 | 222.356 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 4.27 | -93.06 | 4 | 3 | 2 | 45 | 223.364 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 5.22 | -34.96 | 3 | 3 | 1 | 43 | 222.356 | 6 | ↓ |
