In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 25 | Yes |
Popular Name: 2-(4-benzylpiperazin-1-yl)-N-(2-methylsulfanylphenyl)acetamide 2-(4-benzylpiperazin-1-yl)-N-(2-…
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) | 3.19 | 9.08 | -39.16 | 2 | 4 | 1 | 37 | 356.515 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.19 | 6.87 | -8.31 | 1 | 4 | 0 | 36 | 355.507 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.19 | 9.14 | -38.26 | 2 | 4 | 1 | 37 | 356.515 | 6 | ↓ |