| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 24 | No |
Popular Name: 1-[(2-nitrophenyl)methyl]-4-(o-tolylmethyl)piperazine 1-[(2-nitrophenyl)methyl]-4-(o-t…
| 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) | 3.34 | 11.18 | -37.39 | 1 | 5 | 1 | 53 | 326.42 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.34 | 11.11 | -41.46 | 1 | 5 | 1 | 53 | 326.42 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.34 | 9.2 | -8.85 | 0 | 5 | 0 | 52 | 325.412 | 5 | ↓ |
