In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 20 | Yes |
Popular Name: 4-[4-(dimethylamino)-1-piperidyl]-1-phenyl-butan-1-one 4-[4-(dimethylamino)-1-piperidyl…
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) | 2.45 | 8.5 | -37.68 | 1 | 3 | 1 | 25 | 275.416 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.45 | 8.11 | -42 | 1 | 3 | 1 | 25 | 275.416 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.45 | 10.75 | -103.45 | 2 | 3 | 2 | 26 | 276.424 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.