| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 17 | Yes |
Popular Name: (2S)-2-[[cycloheptyl(methyl)amino]methyl]pentanedinitrile (2S)-2-[[cycloheptyl(methyl)amin…
| 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) | 2.64 | 8.76 | -54.07 | 1 | 3 | 1 | 52 | 234.367 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.64 | 6.94 | -12.19 | 0 | 3 | 0 | 51 | 233.359 | 5 | ↓ |
