| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 20 | Yes |
Popular Name: (2S)-N2-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-N1,N1-diethyl-propane-1,2-diamine (2S)-N2-[(7-bromo-1,3-benzodioxo…
| 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) | 3.24 | 6.29 | -43.24 | 2 | 4 | 1 | 38 | 344.273 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.24 | 6.77 | -39.03 | 2 | 4 | 1 | 35 | 344.273 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.24 | 8.04 | -124.29 | 3 | 4 | 2 | 40 | 345.281 | 7 | ↓ |
