| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 17 | No |
Popular Name: N'-[(4-bromo-3-nitro-phenyl)methyl]-N,N-dimethyl-ethane-1,2-diamine N'-[(4-bromo-3-nitro-phenyl)meth…
| 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) | 2.22 | 6.36 | -44.48 | 2 | 5 | 1 | 62 | 303.18 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.22 | 5.25 | -57.01 | 2 | 5 | 1 | 66 | 303.18 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.22 | 3.88 | -7.94 | 1 | 5 | 0 | 61 | 302.172 | 6 | ↓ |
