General Information of the Compound
| Compound ID |
CP0488707
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9216182, 1.4
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H27N5O3
|
||||||||||||||||||
| Molecular Weight |
373.457
|
||||||||||||||||||
| Canonical SMILES |
NC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H27N5O3/c20-18(25)14-1-4-17(21-13-14)23-7-5-16(6-8-23)27-19(26)24-11-9-22(10-12-24)15-2-3-15/h1,4,13,15-16H,2-3,5-12H2,(H2,20,25)
Show/Hide
|
||||||||||||||||||
| InChIKey |
LUUPSXSATRSQKG-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