In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 16 | Yes |
Popular Name: 6-[[[(1S,2R)-2-methylcyclopropyl]amino]methyl]-1,3-benzodioxol-5-ol 6-[[[(1S,2R)-2-methylcyclopropyl…
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) | 2.28 | 2.92 | -42.45 | 3 | 4 | 1 | 55 | 222.264 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.28 | 3.58 | -31.51 | 2 | 4 | 0 | 58 | 221.256 | 3 | ↓ |