| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 18th, 2009 | 32 | Yes |
Popular Name: 2-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]-1-[4-(2-thienylmethyl)piperazin-1-yl]ethanone 2-[4-(p-tolylsulfonyl)-1,4-diaze…
| 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) | 2.40 | 8.25 | -45.73 | 1 | 7 | 1 | 65 | 477.676 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.40 | 5.9 | -12.67 | 0 | 7 | 0 | 64 | 476.668 | 6 | ↓ |
