| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 19 | Yes |
Popular Name: (1S,2R,4R)-N2-(1-ethyl-4-piperidyl)-N1,N2,4-trimethyl-cyclohexane-1,2-diamine (1S,2R,4R)-N2-(1-ethyl-4-piperid…
| 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) | 2.32 | 6.04 | -32.41 | 2 | 3 | 1 | 20 | 268.469 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.32 | 6.93 | -112.01 | 3 | 3 | 2 | 24 | 269.477 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.32 | 8.3 | -100.95 | 3 | 3 | 2 | 21 | 269.477 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.32 | 7.23 | -80.58 | 3 | 3 | 2 | 24 | 269.477 | 4 | ↓ |
