| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: 4-(isopropylamino)-1-[4-(2-thienylmethyl)piperazin-1-yl]butan-1-one 4-(isopropylamino)-1-[4-(2-thien…
| 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) | 1.85 | 6.25 | -43.28 | 2 | 4 | 1 | 40 | 310.487 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.85 | 8.46 | -94.72 | 3 | 4 | 2 | 41 | 311.495 | 7 | ↓ |
