| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 2009 | 16 | Yes |
Popular Name: (2S)-1-(dimethylamino)-3-[[3-(dimethylamino)-2,2-dimethyl-propyl]amino]propan-2-ol (2S)-1-(dimethylamino)-3-[[3-(di…
| 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) | 0.32 | 4.61 | -170.31 | 5 | 4 | 3 | 46 | 234.408 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.32 | 1.03 | -33.87 | 3 | 4 | 1 | 40 | 232.392 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.32 | 3.41 | -75.89 | 4 | 4 | 2 | 41 | 233.4 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.32 | 5.15 | -94.45 | 4 | 4 | 2 | 49 | 233.4 | 8 | ↓ |
