General Information of the Compound
| Compound ID |
CP0534441
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[4-(4-aminopiperidin-1-yl)-5-(3,5-dichlorophenyl)pyridin-3-yl]-2,5-dimethyl-1,3-oxazole-4-carboxamide
Show/Hide
|
||||||||||||||||||
| Formula |
C22H23Cl2N5O2
|
||||||||||||||||||
| Molecular Weight |
460.365
|
||||||||||||||||||
| Canonical SMILES |
Cc1nc(C(=O)Nc2cncc(-c3cc(Cl)cc(Cl)c3)c2N2CCC(N)CC2)c(C)o1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H23Cl2N5O2/c1-12-20(27-13(2)31-12)22(30)28-19-11-26-10-18(14-7-15(23)9-16(24)8-14)21(19)29-5-3-17(25)4-6-29/h7-11,17H,3-6,25H2,1-2H3,(H,28,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
JLVGJNYYORPCPG-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 | |||||||||||||||||||
| 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