| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2008 | 22 | Yes |
Popular Name: 2-[(2S)-4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-1-methyl-piperazin-2-yl]ethanol 2-[(2S)-4-[(7-methoxy-1,3-benzod…
| 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) | 0.94 | 1.53 | -42.46 | 2 | 6 | 1 | 56 | 309.386 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.94 | 1.46 | -49.33 | 2 | 6 | 1 | 56 | 309.386 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.94 | -0.79 | -9.86 | 1 | 6 | 0 | 54 | 308.378 | 5 | ↓ |
