In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 2nd, 2011 | 28 | Yes |
Popular Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-methyl-N-[(4-methylsulfanylphenyl)methyl]acetamide 2-[4-(4-methoxyphenyl)piperazin-…
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) | 3.17 | 9.16 | -11.24 | 0 | 5 | 0 | 36 | 399.56 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.17 | 11.33 | -45.44 | 1 | 5 | 1 | 37 | 400.568 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.