| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 19 | Yes |
Popular Name: N-[[4-bromo-2-(4-methyl-1,4-diazepan-1-yl)phenyl]methyl]ethanamine N-[[4-bromo-2-(4-methyl-1,4-diaz…
| 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) | 2.87 | 9.82 | -93.62 | 3 | 3 | 2 | 24 | 328.298 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.87 | 7.84 | -41.28 | 2 | 3 | 1 | 23 | 327.29 | 4 | ↓ |
