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name Structure Reference Source Properties Activities Metabolism

Adenine; 6-N,N-Di-Me 

AlkaPlorer ID: AK022326

Synonym: None

IUPAC Name: N,N-dimethyl-7H-purin-6-amine

Structure

SMILES: CN(C)C1=NC=NC2=C1N=CN2

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InChI: InChI=1S/C7H9N5/c1-12(2)7-5-6(9-3-8-5)10-4-11-7/h3-4H,1-2H3,(H,8,9,10,11)

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InChIKey: BVIAOQMSVZHOJM-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Spiraea formosana Spiraea Rosaceae Rosales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 163.184

TPSA？: 57.7

MolLogP？: 0.4188999999999999

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens 3-phosphoinositide dependent protein kinase-1 Ki 7943.28 nM None
Homo sapiens 3-phosphoinositide dependent protein kinase-1 Thermal melting change 0.1 degrees C 10.1073/pnas.0708800104
Homo sapiens AMP-activated protein kinase, alpha-2 subunit Thermal melting change -0.6 degrees C 10.1073/pnas.0708800104
Homo sapiens CaM kinase I delta Thermal melting change 0.0 degrees C 10.1073/pnas.0708800104
Homo sapiens CaM kinase I gamma Thermal melting change -0.1 degrees C 10.1073/pnas.0708800104
Homo sapiens CaM kinase II alpha Thermal melting change 1.7 degrees C 10.1073/pnas.0708800104
Homo sapiens CaM kinase II beta Thermal melting change 0.0 degrees C 10.1073/pnas.0708800104
Homo sapiens CaM kinase II delta Thermal melting change -0.2 degrees C 10.1073/pnas.0708800104
Homo sapiens CaM kinase II gamma Thermal melting change 0.0 degrees C 10.1073/pnas.0708800104
Homo sapiens CaM kinase IV Thermal melting change 0.1 degrees C 10.1073/pnas.0708800104
Homo sapiens CaM-kinase kinase beta Thermal melting change 1.0 degrees C 10.1073/pnas.0708800104
Homo sapiens cAMP-dependent protein kinase alpha-catalytic subunit Ki 15848.93 nM None
Homo sapiens cAMP-dependent protein kinase alpha-catalytic subunit Thermal melting change 0.7 degrees C 10.1073/pnas.0708800104
Homo sapiens Casein kinase I gamma 1 Thermal melting change -0.1 degrees C 10.1073/pnas.0708800104
Homo sapiens Casein kinase I gamma 2 Thermal melting change 0.5 degrees C 10.1073/pnas.0708800104
Homo sapiens Casein kinase I isoform gamma-3 Thermal melting change 0.5 degrees C 10.1073/pnas.0708800104
Homo sapiens Cyclin-dependent kinase 2 Thermal melting change 0.3 degrees C 10.1073/pnas.0708800104
Homo sapiens Cyclin-dependent kinase 2/cyclin E1 Ki 1096.48 nM 10.1021/jm200979x
Homo sapiens Cyclin-dependent kinase 6 Thermal melting change 0.1 degrees C 10.1073/pnas.0708800104
Homo sapiens Cyclin-dependent kinase-like 1 Thermal melting change 0.0 degrees C 10.1073/pnas.0708800104
Homo sapiens Death-associated protein kinase 3 Thermal melting change 0.9 degrees C 10.1073/pnas.0708800104
Homo sapiens Dual specificity mitogen-activated protein kinase kinase 2 Thermal melting change -0.2 degrees C 10.1073/pnas.0708800104
Homo sapiens Dual specificity mitogen-activated protein kinase kinase 6 Thermal melting change 0.2 degrees C 10.1073/pnas.0708800104
Homo sapiens Dual specificity protein kinase CLK2 Thermal melting change 0.9 degrees C 10.1073/pnas.0708800104
Homo sapiens Dual specificity protein kinase CLK3 Thermal melting change 0.4 degrees C 10.1073/pnas.0708800104
Homo sapiens Dual specificty protein kinase CLK1 Thermal melting change 1.3 degrees C 10.1073/pnas.0708800104
Homo sapiens Glycogen synthase kinase-3 beta Thermal melting change 0.7 degrees C 10.1073/pnas.0708800104
Homo sapiens Heat shock protein HSP90 IC50 1500000.0 nM 10.1021/acs.jmedchem.0c00242
Homo sapiens HeLa Activity 5.0 mM 10.1073/pnas.0708800104
Homo sapiens Inactive serine/threonine-protein kinase VRK3 Thermal melting change -1.0 degrees C 10.1073/pnas.0708800104
Homo sapiens Leucine-rich repeat serine/threonine-protein kinase 2 IC50 3355.0 nM 10.1021/acs.jmedchem.1c00720
Homo sapiens Leucine-rich repeat serine/threonine-protein kinase 2 Ki 1425.0 nM 10.1021/acs.jmedchem.1c00720
Homo sapiens MAP kinase ERK1 Thermal melting change 0.4 degrees C 10.1073/pnas.0708800104
Homo sapiens MAP kinase p38 beta Thermal melting change 0.1 degrees C 10.1073/pnas.0708800104
Homo sapiens MAP/microtubule affinity-regulating kinase 2 Ki 7943.28 nM None
Homo sapiens Mitogen-activated protein kinase 6 Thermal melting change -0.1 degrees C 10.1073/pnas.0708800104
Homo sapiens Mitogen-activated protein kinase kinase kinase 5 Inhibition 30.0 % 10.1016/j.bmc.2010.11.004
Homo sapiens Mitogen-activated protein kinase kinase kinase 5 Thermal melting change 2.8 degrees C 10.1073/pnas.0708800104
Homo sapiens Myotonin-protein kinase Thermal melting change 0.8 degrees C 10.1073/pnas.0708800104
Homo sapiens PDZ-binding kinase Thermal melting change 0.5 degrees C 10.1073/pnas.0708800104
Homo sapiens Phosphatidylinositol 4-kinase, PI4K IC50 218000.0 nM 10.1021/jm00170a005
Homo sapiens Phosphatidylinositol 4-kinase, PI4K Ki 150200.0 nM 10.1021/jm00170a005
Homo sapiens Protein kinase C delta Ki 12589.25 nM None
Homo sapiens Protein tyrosine kinase 2 beta Ki 10000.0 nM 10.1021/jm200979x
Homo sapiens Ribosomal protein S6 kinase alpha 3 Ki 5011.87 nM None
Homo sapiens Ribosomal protein S6 kinase alpha 3 Thermal melting change 0.6 degrees C 10.1073/pnas.0708800104
Homo sapiens Ribosomal protein S6 kinase alpha 3 Thermal melting change 0.8 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase 10 Thermal melting change -0.4 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase 16 Thermal melting change 0.5 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase 17A Thermal melting change 1.5 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase 2 Thermal melting change 0.8 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase 25 Thermal melting change 0.9 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase 38 Thermal melting change 0.3 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase Aurora-A Ki 3981.07 nM None
Homo sapiens Serine/threonine-protein kinase Chk1 Ki 12589.25 nM None
Homo sapiens Serine/threonine-protein kinase Chk2 Ki 3981.07 nM None
Homo sapiens Serine/threonine-protein kinase Chk2 Thermal melting change 0.5 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase c-TAK1 Ki 5011.87 nM None
Homo sapiens Serine/threonine-protein kinase MST1 Thermal melting change 1.1 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase MST4 Thermal melting change 0.0 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase MST4 Thermal melting change 0.1 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase NEK2 Thermal melting change 0.8 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase NEK6 Thermal melting change 0.0 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase OSR1 Thermal melting change 1.1 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase PAK 4 Thermal melting change 0.5 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase PAK6 Thermal melting change -0.3 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase PAK7 Thermal melting change 0.0 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase PCTAIRE-1 Thermal melting change -0.3 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase PIM1 Thermal melting change 0.0 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase PIM2 Thermal melting change 0.3 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase PIM3 Thermal melting change 0.9 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase PLK1 Thermal melting change 0.5 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase PLK4 Thermal melting change 1.3 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase RIO2 Thermal melting change 0.1 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase VRK1 Thermal melting change 0.0 degrees C 10.1073/pnas.0708800104
Homo sapiens Serine/threonine-protein kinase VRK2 Thermal melting change 0.0 degrees C 10.1073/pnas.0708800104
Homo sapiens TRAF2- and NCK-interacting kinase Thermal melting change 0.0 degrees C 10.1073/pnas.0708800104
Homo sapiens Tyrosine-protein kinase JAK1 Thermal melting change 0.9 degrees C 10.1073/pnas.0708800104
Homo sapiens Tyrosine-protein kinase ZAP-70 Ki 10000.0 nM 10.1021/jm200979x
Rattus norvegicus GABA-A receptor; anion channel Inhibition 57.0 % 10.1021/jm00125a015
None No relevant target LogD7.4 0.95 None 10.6019/CHEMBL3301361
None Unchecked IC50 300000.0 nM 10.1073/pnas.0708800104
None Unchecked MOTILITY REDUCTION/CYTOTOXICITY 0.0 % 10.6019/CHEMBL3988181

Metabolism Information