| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2011 | 19 | Yes |
Popular Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-2-piperazin-1-yl-ethanamine N-methyl-N-[(4-methylsulfanylphe…
| 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) | 1.50 | 6.58 | -96.82 | 3 | 3 | 2 | 24 | 281.469 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.50 | 4.23 | -40.17 | 2 | 3 | 1 | 23 | 280.461 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.50 | 5.23 | -40.09 | 2 | 3 | 1 | 20 | 280.461 | 6 | ↓ |
