| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 18 | Yes |
Popular Name: (1R,3S)-1-(aminomethyl)-N,3-dimethyl-N-(2-pyridylmethyl)cyclohexanamine (1R,3S)-1-(aminomethyl)-N,3-dime…
| 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) | 1.36 | 5.82 | -114.67 | 4 | 3 | 2 | 45 | 249.402 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.36 | 4.65 | -98.98 | 4 | 3 | 2 | 45 | 249.402 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.36 | 3.93 | -38.32 | 3 | 3 | 1 | 44 | 248.394 | 4 | ↓ |
