| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 18 | Yes |
Popular Name: 6-[[[(3S)-1-methylpyrrolidin-3-yl]amino]methyl]-1,3-benzodioxol-5-ol 6-[[[(3S)-1-methylpyrrolidin-3-y…
| 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) | 1.45 | 0.21 | -46 | 3 | 5 | 1 | 59 | 251.306 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 1.68 | -39.99 | 3 | 5 | 1 | 55 | 251.306 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | -0.93 | -5.81 | 2 | 5 | 0 | 54 | 250.298 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 0.86 | -35.77 | 2 | 5 | 0 | 61 | 250.298 | 3 | ↓ |
