| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2010 | 18 | Yes |
Popular Name: N'-[(3-bromophenyl)methyl]-N-[(1S)-2-methoxy-1-methyl-ethyl]-N'-methyl-ethane-1,2-diamine N'-[(3-bromophenyl)methyl]-N-[(1…
| 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) | 2.63 | 6.25 | -39.19 | 2 | 3 | 1 | 26 | 316.263 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.63 | 3.92 | -3.2 | 1 | 3 | 0 | 24 | 315.255 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.63 | 5.16 | -37.44 | 2 | 3 | 1 | 29 | 316.263 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.63 | 7.48 | -117.51 | 3 | 3 | 2 | 30 | 317.271 | 8 | ↓ |
