| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 18 | Yes |
Popular Name: (2S)-N2-[(3-bromophenyl)methyl]-N1-(2-methoxyethyl)-N2-methyl-propane-1,2-diamine (2S)-N2-[(3-bromophenyl)methyl]-…
| 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) | 2.27 | 6.04 | -36.37 | 2 | 3 | 1 | 26 | 316.263 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.27 | 4.2 | -3.34 | 1 | 3 | 0 | 24 | 315.255 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 5.61 | -36.53 | 2 | 3 | 1 | 29 | 316.263 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.27 | 7.5 | -117.79 | 3 | 3 | 2 | 30 | 317.271 | 8 | ↓ |
