4-(1H-indol-2-yl)-1,2-dihydropyrimidin-2-imine
AlkaPlorer ID: AK039298
Synonym: None
IUPAC Name: 4-(1H-indol-2-yl)pyrimidin-2-amine
Structure
SMILES: NC1=NC=CC(C2=CC3=CC=CC=C3N2)=N1
InChI: InChI=1S/C12H10N4/c13-12-14-6-5-10(16-12)11-7-8-3-1-2-4-9(8)15-11/h1-7,15H,(H2,13,14,16)
InChIKey: DMIMDIGPBYDVRA-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 210.24
TPSA？: 67.59
MolLogP？: 2.2071
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | cAMP-dependent protein kinase (PKA) | IC50 | 500000.0 | nM | 10.1016/j.bmcl.2004.01.050 |
| Homo sapiens | Casein kinase I | IC50 | nan | nM | 10.1016/j.bmcl.2004.01.050 |
| Homo sapiens | Cyclin-dependent kinase 1/cyclin B | IC50 | 140000.0 | nM | 10.1016/j.bmcl.2004.01.050 |
| Homo sapiens | Cyclin-dependent kinase 5/CDK5 activator 1 | IC50 | 130000.0 | nM | 10.1016/j.bmcl.2004.01.050 |
| Homo sapiens | Glycogen synthase kinase-3 beta | IC50 | 420000.0 | nM | 10.1016/j.bmcl.2004.01.050 |
| Homo sapiens | Glycogen synthase kinase-3 beta | IC50 | 420000.0 | nM | 10.1016/j.ejmech.2008.08.012 |
| None | Unchecked | IC50 | 1000000.0 | nM | 10.1016/j.bmcl.2004.01.050 |