In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 25 | No |
Popular Name: 1-[(4-ethylphenyl)methyl]-4-[(2-nitrophenyl)methyl]piperazine 1-[(4-ethylphenyl)methyl]-4-[(2-…
None
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) | 3.86 | 11.61 | -35.12 | 1 | 5 | 1 | 53 | 340.447 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.86 | 12.33 | -42.18 | 1 | 5 | 1 | 53 | 340.447 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.86 | 10 | -8.59 | 0 | 5 | 0 | 52 | 339.439 | 6 | ↓ |