General Information of the Compound
Compound ID
CP0386078
Compound Name
2-(5-aminopyridin-2-yl)-5,6-dimethylpyrimidin-4-ol
    Show/Hide
Structure
Formula
C11H12N4O
Molecular Weight
216.244
Canonical SMILES
Cc1nc([nH]c(=O)c1C)-c1ccc(N)cn1
    Show/Hide
InChI
InChI=1S/C11H12N4O/c1-6-7(2)14-10(15-11(6)16)9-4-3-8(12)5-13-9/h3-5H,12H2,1-2H3,(H,14,15,16)
    Show/Hide
InChIKey
BKBOUEHARKABDE-UHFFFAOYSA-N
Physicochemical Property
logP
1.03094
Rotatable Bonds
1
Heavy Atom Count
16
Polar Areas
84.66
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Complexity
16

"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
CID: 135909406
SID: 57292533
ChEMBL ID
CHEMBL1269395
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: PT02791, Hypoxia-inducible factor 1-alpha
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000118 U-251MG Homo sapiens (Human)  1
1
IC50 > 30000 nM
   TI
   LI
   LO
   TS