| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 21 | Yes |
Popular Name: 1-(4-bromophenyl)-4-[4-(dimethylamino)-1-piperidyl]butan-1-one 1-(4-bromophenyl)-4-[4-(dimethyl…
| 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) | 3.26 | 9.12 | -37.7 | 1 | 3 | 1 | 25 | 354.312 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.26 | 8.74 | -43.55 | 1 | 3 | 1 | 25 | 354.312 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.26 | 11.37 | -105.59 | 2 | 3 | 2 | 26 | 355.32 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
