| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 19 | Yes |
Popular Name: 4-[[(2R)-2-dimethylamino-2-(3-methoxyphenyl)ethyl]amino]butanenitrile 4-[[(2R)-2-dimethylamino-2-(3-me…
| 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) | 1.12 | 7.63 | -43.06 | 2 | 4 | 1 | 49 | 262.377 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 6.1 | -54.06 | 2 | 4 | 1 | 53 | 262.377 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 8.08 | -136.91 | 3 | 4 | 2 | 54 | 263.385 | 8 | ↓ |
