General Information of the Compound
| Compound ID |
CP0539011
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US10227332, No. 8
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H27N3O
|
||||||||||||||||||
| Molecular Weight |
349.478
|
||||||||||||||||||
| Canonical SMILES |
CCCCCn1c2ccccc2c2cc(ccc12)C(=O)N1CCNCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H27N3O/c1-2-3-6-13-25-20-8-5-4-7-18(20)19-16-17(9-10-21(19)25)22(26)24-14-11-23-12-15-24/h4-5,7-10,16,23H,2-3,6,11-15H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
FPWGARRGHTWQJZ-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