In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 16 | Yes |
Popular Name: 6-[[[(1S)-2-hydroxy-1-methyl-ethyl]amino]methyl]-1,3-benzodioxol-5-ol 6-[[[(1S)-2-hydroxy-1-methyl-eth…
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) | 1.00 | -1.37 | -42.8 | 4 | 5 | 1 | 76 | 226.252 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.00 | -0.71 | -31.34 | 3 | 5 | 0 | 78 | 225.244 | 4 | ↓ |