In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 24 | Yes |
Popular Name: 1-[(4-ethylphenyl)methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazine 1-[(4-ethylphenyl)methyl]-4-[(4-…
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) | 4.38 | 11.88 | -37.36 | 1 | 2 | 1 | 8 | 341.544 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.38 | 9.62 | -3.82 | 0 | 2 | 0 | 6 | 340.536 | 6 | ↓ |