General Information of the Compound
Compound ID
CP0560435
Compound Name
4-(2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)morpholine
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Structure
Formula
C14H18N4O2S
Molecular Weight
306.391
Canonical SMILES
C1CN(CCO1)c1nc(N2CCOCC2)c2sccc2n1
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InChI
InChI=1S/C14H18N4O2S/c1-10-21-12-11(1)15-14(18-4-8-20-9-5-18)16-13(12)17-2-6-19-7-3-17/h1,10H,2-9H2
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InChIKey
WZDSAEDQRWUJTE-UHFFFAOYSA-N
Physicochemical Property
logP
1.3645
Rotatable Bonds
2
Heavy Atom Count
21
Polar Areas
50.72
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
7
Complexity
21

"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).

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PubChem ID
CID: 72947132
ChEMBL ID
CHEMBL4065390
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
Protein ID: PT01065, Serine/threonine-protein kinase mTOR
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000012 Sf21 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 > 2000 nM
   TI
   LI
   LO
   TS