| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 26th, 2009 | 19 | Yes |
Popular Name: 4-[[[(1S)-1-(4-bromophenyl)ethyl]amino]methyl]benzonitrile 4-[[[(1S)-1-(4-bromophenyl)ethyl…
| 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) | 4.02 | 9.91 | -56.92 | 2 | 2 | 1 | 40 | 316.222 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.02 | 8.77 | -5.97 | 1 | 2 | 0 | 36 | 315.214 | 4 | ↓ |
