| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 20 | Yes |
Popular Name: 3-[[[(1S)-1-(2,4-dibromophenyl)ethyl]amino]methyl]benzonitrile 3-[[[(1S)-1-(2,4-dibromophenyl)e…
| 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) | 4.73 | 10.42 | -53.61 | 2 | 2 | 1 | 40 | 395.118 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.73 | 9.25 | -5.94 | 1 | 2 | 0 | 36 | 394.11 | 4 | ↓ |
