In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 25 | Yes |
Popular Name: [4-(diethylaminomethyl)-1-piperidyl]-(2-hydroxy-4-quinolyl)methanone [4-(diethylaminomethyl)-1-piperi…
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) | 1.91 | 8.87 | -45.35 | 2 | 5 | 1 | 58 | 342.463 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.82 | 6.43 | -72.05 | 1 | 5 | 0 | 61 | 341.455 | 5 | ↓ |