| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 21 | Yes |
Popular Name: 6-[[[(2S)-2-(dimethylamino)-4-methyl-pentyl]amino]methyl]-1,3-benzodioxol-5-ol 6-[[[(2S)-2-(dimethylamino)-4-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) | 2.97 | 2.95 | -48.59 | 3 | 5 | 1 | 59 | 295.403 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.97 | 3.69 | -33.35 | 2 | 5 | 0 | 61 | 294.395 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.97 | 3.7 | -41.46 | 3 | 5 | 1 | 55 | 295.403 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.97 | 5.09 | -130.61 | 4 | 5 | 2 | 60 | 296.411 | 7 | ↓ |
