| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 15 | Yes |
Popular Name: (2S)-3-[[(1R,2S)-2-aminocycloheptyl]-methyl-amino]-2-methyl-propanenitrile (2S)-3-[[(1R,2S)-2-aminocyclohep…
| 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) | 1.64 | 3.65 | -39.5 | 3 | 3 | 1 | 55 | 210.345 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 5.3 | -138.29 | 4 | 3 | 2 | 56 | 211.353 | 3 | ↓ |
