General Information of the Compound
| Compound ID |
CP0470532
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[2,6-bis(4-acetylphenyl)pyrimidin-4-yl]propanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H21N3O3
|
||||||||||||||||||
| Molecular Weight |
387.439
|
||||||||||||||||||
| Canonical SMILES |
CCC(=O)Nc1cc(nc(n1)-c1ccc(cc1)C(C)=O)-c1ccc(cc1)C(C)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H21N3O3/c1-4-22(29)25-21-13-20(18-9-5-16(6-10-18)14(2)27)24-23(26-21)19-11-7-17(8-12-19)15(3)28/h5-13H,4H2,1-3H3,(H,24,25,26,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZJHQIRJETMZORC-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound