| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 19 | Yes |
Popular Name: (2R,4S)-2-ethyl-N2,4-dimethyl-N2-(2-pyridylmethyl)hexane-1,2-diamine (2R,4S)-2-ethyl-N2,4-dimethyl-N2…
| 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) | 2.21 | 6.63 | -123.15 | 4 | 3 | 2 | 45 | 265.445 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.21 | 4.68 | -48.91 | 3 | 3 | 1 | 44 | 264.437 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.21 | 6.92 | -27.79 | 3 | 3 | 1 | 43 | 264.437 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 5.3 | -102.75 | 4 | 3 | 2 | 45 | 265.445 | 8 | ↓ |
