| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 17 | Yes |
Popular Name: (1S)-1-(4-bromophenyl)-N-isopropyl-N-propyl-ethane-1,2-diamine (1S)-1-(4-bromophenyl)-N-isoprop…
| 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) | 3.09 | 6.72 | -129.39 | 4 | 2 | 2 | 32 | 301.272 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 5.57 | -45.53 | 3 | 2 | 1 | 31 | 300.264 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 7.58 | -30.61 | 3 | 2 | 1 | 30 | 300.264 | 6 | ↓ |
