General Information of the Compound
| Compound ID |
CP0414520
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9409917, 63
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H17N3O3
|
||||||||||||||||||
| Molecular Weight |
275.308
|
||||||||||||||||||
| Canonical SMILES |
NC(=O)C1(CCCC1)NC(=O)C1COc2ncccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H17N3O3/c15-13(19)14(5-1-2-6-14)17-11(18)10-8-20-12-9(10)4-3-7-16-12/h3-4,7,10H,1-2,5-6,8H2,(H2,15,19)(H,17,18)
Show/Hide
|
||||||||||||||||||
| InChIKey |
YHXBKTLNTIEPPE-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