| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: (2S)-N2-[[5-bromo-2-(difluoromethoxy)phenyl]methyl]-N1,N1-diethyl-propane-1,2-diamine (2S)-N2-[[5-bromo-2-(difluoromet…
| 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) | 3.96 | 6.93 | -37.53 | 2 | 3 | 1 | 29 | 366.27 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.96 | 5.81 | -3.49 | 1 | 3 | 0 | 24 | 365.262 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.96 | 7.71 | -36.51 | 2 | 3 | 1 | 26 | 366.27 | 9 | ↓ |
