| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 17 | Yes |
Popular Name: (1S,2S)-2-[2-dimethylaminoethyl(propyl)amino]cyclohexanecarbonitrile (1S,2S)-2-[2-dimethylaminoethyl(…
| 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) | 2.81 | 6.85 | -38.48 | 1 | 3 | 1 | 31 | 238.399 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.81 | 4.36 | -4.08 | 0 | 3 | 0 | 30 | 237.391 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.81 | 8.68 | -100.11 | 2 | 3 | 2 | 33 | 239.407 | 6 | ↓ |
