| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 19 | Yes |
Popular Name: 3-(ethylamino)-1-[4-(2-thienylmethyl)piperazin-1-yl]propan-1-one 3-(ethylamino)-1-[4-(2-thienylme…
| 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) | 0.93 | 4.92 | -45.62 | 2 | 4 | 1 | 40 | 282.433 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.93 | 7.13 | -100.28 | 3 | 4 | 2 | 41 | 283.441 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
