| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 17 | Yes |
Popular Name: (1R,2S)-N1,N2-dimethyl-N2-(2-pyridylmethyl)cyclohexane-1,2-diamine (1R,2S)-N1,N2-dimethyl-N2-(2-pyr…
| 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) | 1.74 | 6.1 | -33.2 | 2 | 3 | 1 | 29 | 234.367 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 5.04 | -30.69 | 2 | 3 | 1 | 33 | 234.367 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.74 | 5.79 | -87.83 | 3 | 3 | 2 | 34 | 235.375 | 4 | ↓ |
