| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2009 | 21 | Yes |
Popular Name: (2S)-2-[[[(1R)-1-(2,5-dimethoxyphenyl)ethyl]amino]methyl]pentanedinitrile (2S)-2-[[[(1R)-1-(2,5-dimethoxyp…
| 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) | 1.98 | 5.9 | -18.18 | 1 | 5 | 0 | 78 | 287.363 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.98 | 6.94 | -61.06 | 2 | 5 | 1 | 83 | 288.371 | 8 | ↓ |
