| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 20 | Yes |
Popular Name: (1S,2R,4S)-N1,N2-dimethyl-4-propyl-N2-(3-pyridylmethyl)cyclohexane-1,2-diamine (1S,2R,4S)-N1,N2-dimethyl-4-prop…
| 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) | 2.93 | 7.35 | -38.5 | 2 | 3 | 1 | 33 | 276.448 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.93 | 8.7 | -36.35 | 2 | 3 | 1 | 29 | 276.448 | 6 | ↓ |
