| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 16 | Yes |
Popular Name: (2R)-2-[4-(dimethylamino)butylamino]-N-prop-2-ynyl-propanamide (2R)-2-[4-(dimethylamino)butylam…
| 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) | 0.27 | 4.68 | -94.09 | 4 | 4 | 2 | 50 | 227.352 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.27 | 3.52 | -39.18 | 3 | 4 | 1 | 46 | 226.344 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.45 | 2.22 | -74.48 | 3 | 4 | 1 | 56 | 226.344 | 8 | ↓ |
