| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 19 | Yes |
Popular Name: 2-[2-[[[2-(dimethylamino)-2-methyl-propyl]amino]methyl]phenoxy]acetonitrile 2-[2-[[[2-(dimethylamino)-2-meth…
| 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) | 2.13 | 7.72 | -111.7 | 3 | 4 | 2 | 54 | 263.385 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 5.6 | -37.86 | 2 | 4 | 1 | 53 | 262.377 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 6.54 | -36.12 | 2 | 4 | 1 | 49 | 262.377 | 7 | ↓ |
