| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 19 | Yes |
Popular Name: (1S)-1-(7-bromo-1,3-benzodioxol-5-yl)-N-isobutyl-N-methyl-ethane-1,2-diamine (1S)-1-(7-bromo-1,3-benzodioxol-…
| 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) | 2.48 | 5.37 | -135.51 | 4 | 4 | 2 | 51 | 331.254 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.48 | 3.3 | -51.5 | 3 | 4 | 1 | 49 | 330.246 | 5 | ↓ |
