| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 17 | Yes |
Popular Name: 6-[[[(1S)-1-(hydroxymethyl)propyl]amino]methyl]-1,3-benzodioxol-5-ol 6-[[[(1S)-1-(hydroxymethyl)propy…
| 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) | 1.54 | -0.58 | -41.97 | 4 | 5 | 1 | 76 | 240.279 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.54 | 0.08 | -34.1 | 3 | 5 | 0 | 78 | 239.271 | 5 | ↓ |
