General Information of the Compound
| Compound ID |
CP0572874
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(2R)-1-(3,3-dimethylpiperidin-1-yl)propan-2-yl]-4-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]benzamide
Show/Hide
|
||||||||||||||||||
| Formula |
C20H25F3N4O2
|
||||||||||||||||||
| Molecular Weight |
410.44
|
||||||||||||||||||
| Canonical SMILES |
C[C@H](CN1CCCC(C)(C)C1)NC(=O)c1ccc(cc1)-c1noc(n1)C(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H25F3N4O2/c1-13(11-27-10-4-9-19(2,3)12-27)24-17(28)15-7-5-14(6-8-15)16-25-18(29-26-16)20(21,22)23/h5-8,13H,4,9-12H2,1-3H3,(H,24,28)/t13-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
BBOXDPRCICCASY-CYBMUJFWSA-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