| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 15 | Yes |
Popular Name: 3-[[(1R,2S)-2-aminocycloheptyl]-ethyl-amino]propanenitrile 3-[[(1R,2S)-2-aminocycloheptyl]-…
| 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) | 0.94 | 3.41 | -47.27 | 3 | 3 | 1 | 55 | 210.345 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.94 | 5.31 | -131.12 | 4 | 3 | 2 | 56 | 211.353 | 4 | ↓ |
