| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 20 | Yes |
Popular Name: (1S,2S,4S)-N1-ethyl-N2-(1-ethyl-4-piperidyl)-N2,4-dimethyl-cyclohexane-1,2-diamine (1S,2S,4S)-N1-ethyl-N2-(1-ethyl-…
| 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) | 2.69 | 7.79 | -29.54 | 2 | 3 | 1 | 20 | 282.496 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.69 | 7.39 | -111.22 | 3 | 3 | 2 | 24 | 283.504 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.69 | 10.03 | -93.82 | 3 | 3 | 2 | 21 | 283.504 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.69 | 7.96 | -91.64 | 3 | 3 | 2 | 24 | 283.504 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.69 | 9.62 | -200.17 | 4 | 3 | 3 | 25 | 284.512 | 5 | ↓ |
