In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2011 | 19 | Yes |
Popular Name: N'-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-N-cyclopropyl-N-methyl-ethane-1,2-diamine N'-[(7-bromo-1,3-benzodioxol-5-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) | 2.52 | 5.87 | -37.89 | 2 | 4 | 1 | 35 | 328.23 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 4.78 | -50.17 | 2 | 4 | 1 | 38 | 328.23 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 7.23 | -125.89 | 3 | 4 | 2 | 40 | 329.238 | 6 | ↓ |