| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 18 | Yes |
Popular Name: 2-methyl-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]propanenitrile 2-methyl-2-[4-(thiophene-2-carbo…
| 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) | 1.76 | 4.12 | -10.15 | 0 | 4 | 0 | 47 | 263.366 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 6.16 | -47.73 | 1 | 4 | 1 | 49 | 264.374 | 2 | ↓ |
