| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 17 | Yes |
Popular Name: (2S)-N2-[(4-bromophenyl)methyl]-N1,N1-diethyl-propane-1,2-diamine (2S)-N2-[(4-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) | 3.42 | 7.3 | -38.69 | 2 | 2 | 1 | 20 | 300.264 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.42 | 8.14 | -35.44 | 2 | 2 | 1 | 16 | 300.264 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.42 | 9.32 | -118.76 | 3 | 2 | 2 | 21 | 301.272 | 7 | ↓ |
