| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2008 | 26 | No |
Popular Name: 3-[[4-[(4-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole 3-[[4-[(4-nitrophenyl)methyl]pip…
| 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) | 3.14 | 10.22 | -47.02 | 2 | 6 | 1 | 69 | 351.43 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.14 | 7.97 | -9.67 | 1 | 6 | 0 | 68 | 350.422 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.14 | 10.22 | -53.94 | 2 | 6 | 1 | 69 | 351.43 | 5 | ↓ |
