General Information of the Compound
| Compound ID |
CP0489154
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-[3-[(1R)-1-[4-(2-aminopyrimidin-5-yl)phenyl]-1-cyclopropylethyl]-1,2,4-oxadiazol-5-yl]-N,N-dimethylpiperazine-1-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H30N8O2
|
||||||||||||||||||
| Molecular Weight |
462.558
|
||||||||||||||||||
| Canonical SMILES |
CN(C)C(=O)N1CCN(CC1)c1nc(no1)[C@](C)(C1CC1)c1ccc(cc1)-c1cnc(N)nc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H30N8O2/c1-24(19-8-9-19,18-6-4-16(5-7-18)17-14-26-21(25)27-15-17)20-28-22(34-29-20)31-10-12-32(13-11-31)23(33)30(2)3/h4-7,14-15,19H,8-13H2,1-3H3,(H2,25,26,27)/t24-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
VUQPWXAOMODNHZ-DEOSSOPVSA-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