| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 19 | Yes |
Popular Name: (1S,2S,4R)-N2-ethyl-N1,4-dimethyl-N2-(4-pyridylmethyl)cyclohexane-1,2-diamine (1S,2S,4R)-N2-ethyl-N1,4-dimethy…
| 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) | 2.01 | 7.58 | -113.12 | 3 | 3 | 2 | 34 | 263.429 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 5.93 | -43.24 | 2 | 3 | 1 | 33 | 262.421 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 6.34 | -37.7 | 2 | 3 | 1 | 29 | 262.421 | 5 | ↓ |
