In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 25 | No |
Popular Name: 1-[(4-ethylphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine 1-[(4-ethylphenyl)methyl]-4-[(4-…
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) | 3.91 | 11.49 | -53.63 | 1 | 5 | 1 | 53 | 340.447 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.91 | 11.43 | -46.26 | 1 | 5 | 1 | 53 | 340.447 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.91 | 9.11 | -7.11 | 0 | 5 | 0 | 52 | 339.439 | 6 | ↓ |