| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 1st, 2011 | 20 | Yes |
Popular Name: 1-[2-[4-(3-thienylmethyl)piperazin-1-yl]ethyl]pyrrolidin-2-one 1-[2-[4-(3-thienylmethyl)piperaz…
| 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) | 0.97 | 6.49 | -40.22 | 1 | 4 | 1 | 28 | 294.444 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.97 | 6.49 | -40.94 | 1 | 4 | 1 | 28 | 294.444 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.97 | 4.24 | -9.65 | 0 | 4 | 0 | 27 | 293.436 | 5 | ↓ |
