| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 35 | No |
Popular Name: N-[6-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]-3-pyridyl]-3-(trifluoromethyl)benzamide N-[6-[4-[(2-nitrophenyl)methyl]p…
| 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) | 4.27 | 11.61 | -17.75 | 1 | 8 | 0 | 94 | 485.466 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.27 | 13.49 | -48.21 | 2 | 8 | 1 | 95 | 486.474 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.27 | 13.83 | -112.58 | 3 | 8 | 2 | 97 | 487.482 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.27 | 11.92 | -46.63 | 2 | 8 | 1 | 96 | 486.474 | 7 | ↓ |
