| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 20 | Yes |
Popular Name: (1S,2R,4S)-N1,4-diethyl-N2-methyl-N2-[(1-methylpyrazol-4-yl)methyl]cyclohexane-1,2-diamine (1S,2R,4S)-N1,4-diethyl-N2-methy…
| 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) | 2.36 | 8.8 | -116.47 | 3 | 4 | 2 | 39 | 280.46 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 7.03 | -38.01 | 2 | 4 | 1 | 38 | 279.452 | 6 | ↓ |
