General Information of the Compound
| Compound ID |
CP0355964
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(3R)-3-methyl-4-[5-[(3S)-3-methylmorpholin-4-yl]-2-(2H-triazol-4-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H22N8O2S
|
||||||||||||||||||
| Molecular Weight |
402.484
|
||||||||||||||||||
| Canonical SMILES |
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cn[nH]n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H22N8O2S/c1-10-8-26-5-3-24(10)14-13-16(28-15(19-13)12-7-18-23-22-12)21-17(20-14)25-4-6-27-9-11(25)2/h7,10-11H,3-6,8-9H2,1-2H3,(H,18,22,23)/t10-,11+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
CAWITACCCGFVAA-MNOVXSKESA-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