General Information of the Compound
| Compound ID |
CP0570310
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2S,6R)-2,6-dimethyl-4-[4-morpholin-4-yl-6-(1H-pyrrol-2-yl)thieno[3,2-d]pyrimidin-2-yl]morpholine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H25N5O2S
|
||||||||||||||||||
| Molecular Weight |
399.52
|
||||||||||||||||||
| Canonical SMILES |
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccc[nH]1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H25N5O2S/c1-13-11-25(12-14(2)27-13)20-22-16-10-17(15-4-3-5-21-15)28-18(16)19(23-20)24-6-8-26-9-7-24/h3-5,10,13-14,21H,6-9,11-12H2,1-2H3/t13-,14+
Show/Hide
|
||||||||||||||||||
| InChIKey |
HRRIWAIVLUGEOW-OKILXGFUSA-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