| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 18 | Yes |
Popular Name: (1R,2S)-N1-ethyl-N2-methyl-N2-[(1-methylpyrazol-4-yl)methyl]cyclohexane-1,2-diamine (1R,2S)-N1-ethyl-N2-methyl-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) | 1.67 | 7.44 | -112.55 | 3 | 4 | 2 | 39 | 252.406 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 4.75 | -4.36 | 1 | 4 | 0 | 33 | 250.39 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.67 | 5.46 | -35.65 | 2 | 4 | 1 | 38 | 251.398 | 5 | ↓ |
