General Information of the Compound
| Compound ID |
CP0482539
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
propan-2-yl 4-[[7-[4-[methoxy(methyl)carbamoyl]phenyl]thieno[3,2-d]pyrimidin-4-yl]-methylamino]piperidine-1-carboxylate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H31N5O4S
|
||||||||||||||||||
| Molecular Weight |
497.621
|
||||||||||||||||||
| Canonical SMILES |
CON(C)C(=O)c1ccc(cc1)-c1csc2c(ncnc12)N(C)C1CCN(CC1)C(=O)OC(C)C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H31N5O4S/c1-16(2)34-25(32)30-12-10-19(11-13-30)28(3)23-22-21(26-15-27-23)20(14-35-22)17-6-8-18(9-7-17)24(31)29(4)33-5/h6-9,14-16,19H,10-13H2,1-5H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
CMKFHPJSHVAITK-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