General Information of the Compound
| Compound ID |
CP0880962
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-(4-Propyl-piperazin-1-yl)-2-pyridin-4-yl-5,6,7,8-tetrahydro-benzo[4,5]thieno[2,3-d]pyrimidine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H27N5S
|
||||||||||||||||||
| Molecular Weight |
393.56
|
||||||||||||||||||
| Canonical SMILES |
CCCN1CCN(c2nc(-c3ccncc3)nc3sc4c(c23)CCCC4)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H27N5S/c1-2-11-26-12-14-27(15-13-26)21-19-17-5-3-4-6-18(17)28-22(19)25-20(24-21)16-7-9-23-10-8-16/h7-10H,2-6,11-15H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
QUEZOJTZNZOPBK-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