| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2008 | 18 | Yes |
Popular Name: 3-[[(3-dimethylamino-2,2-dimethyl-propyl)amino]methyl]benzonitrile 3-[[(3-dimethylamino-2,2-dimethy…
| 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) | 2.42 | 9.07 | -111.46 | 3 | 3 | 2 | 45 | 247.386 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.42 | 7.89 | -37.13 | 2 | 3 | 1 | 40 | 246.378 | 6 | ↓ |
