| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 21 | Yes |
Popular Name: 2-(ethylamino)-2-methyl-1-[4-(thiophene-3-carbonyl)piperazin-1-yl]propan-1-one 2-(ethylamino)-2-methyl-1-[4-(th…
| 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) | 0.68 | 5.12 | -45.07 | 2 | 5 | 1 | 57 | 310.443 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.68 | 5.01 | -12.55 | 1 | 5 | 0 | 53 | 309.435 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
