| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 15 | Yes |
Popular Name: (2S,3R)-N2-methyl-N2-(2-pyridylmethyl)pentane-2,3-diamine (2S,3R)-N2-methyl-N2-(2-pyridylm…
| 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) | 0.64 | 2.7 | -42.48 | 3 | 3 | 1 | 44 | 208.329 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.64 | 3.42 | -85.32 | 4 | 3 | 2 | 45 | 209.337 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.64 | 4.18 | -32.33 | 3 | 3 | 1 | 43 | 208.329 | 5 | ↓ |
