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name Structure Reference Source Properties Activities Metabolism

2-Aminopyridine

AlkaPlorer ID: AK001747

Synonym: None

IUPAC Name: pyridin-2-amine

Structure

SMILES: C1=CC=NC(=C1)N

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InChI: InChI=1S/C5H6N2/c6-5-3-1-2-4-7-5/h1-4H,(H2,6,7)

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InChIKey: ICSNLGPSRYBMBD-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain

Properties Information

Molecule Weight: 94.11699999999999

TPSA？: 38.91

MolLogP？: 0.6638

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Clostridium botulinum Botulinum neurotoxin type A IC50 1800.0 nM 10.1016/j.bmcl.2016.11.019
Homo sapiens Heat shock protein HSP 90-alpha Kd 1000.0 nM 10.1016/j.bmcl.2011.08.001
Homo sapiens Neutrophil cytosol factor 1 Ki 2000000.0 nM 10.1021/acs.jmedchem.9b01492
Homo sapiens Neutrophil cytosol factor 1 Rmax 20.0 % 10.1021/acs.jmedchem.9b01492
Homo sapiens Nitric-oxide synthase, brain Activity 72.0 % 10.1016/j.ejmech.2008.12.007
Homo sapiens Nitric-oxide synthase, brain IC50 4800.0 nM 10.1016/s0960-894x(00)00389-9
Homo sapiens Nitric-oxide synthase, brain IC50 7200.0 nM 10.1021/jm900380j
Homo sapiens Nitric-oxide synthase, endothelial Activity 94.0 % 10.1016/j.ejmech.2008.12.007
Homo sapiens Nitric-oxide synthase, endothelial IC50 2800.0 nM 10.1016/s0960-894x(00)00389-9
Homo sapiens Nitric oxide synthase, inducible Activity 95.0 % 10.1016/j.ejmech.2008.12.007
Homo sapiens Nitric oxide synthase, inducible IC50 1900.0 nM 10.1016/s0960-894x(00)00389-9
Homo sapiens Nitric oxide sythases; iNOS & nNOS Selectivity 1.5 None 10.1016/s0960-894x(00)00389-9
Homo sapiens Nitric oxide sythases; iNOS & nNOS Selectivity 2.5 None 10.1016/s0960-894x(00)00389-9
Homo sapiens Phosphatidylinositol 4-kinase, PI4K IC50 7100.0 nM 10.1021/jm00170a005
Human immunodeficiency virus 1 Human immunodeficiency virus 1 EC50 20000.0 nM 10.1021/jm2001103
Human immunodeficiency virus 1 Human immunodeficiency virus 1 EC90 20.0 uM 10.1021/jm2001103
Mus musculus Tyrosine-protein kinase TEC Kd 4000000.0 nM 10.1021/jm049533z
Rattus norvegicus Neuronal acetylcholine receptor Enhancement 20.0 % 10.1021/jm00147a021
Rattus norvegicus Neuronal acetylcholine receptor Inhibition 378.0 % 10.1021/jm00147a021
Rattus norvegicus Neuronal acetylcholine receptor Kd 200000.0 nM 10.1021/jm00147a021
Rattus norvegicus Neuronal acetylcholine receptor Kd 34000000.0 nM 10.1021/jm00147a021
Rattus norvegicus Neuronal acetylcholine receptor Kd nan nM 10.1021/jm00147a021
Rattus norvegicus Neuronal acetylcholine receptor Mean enhancement of binding 12.4 None 10.1021/jm00147a021
Rattus norvegicus Nitric-oxide synthase, brain IC50 8700.0 nM 10.1021/jm900380j
Rattus norvegicus Nitric-oxide synthase, brain IC50 9300.0 nM 10.1021/jm900380j
Staphylococcus aureus DNA gyrase MNEC 250.0 ug ml-1 10.1021/jm000017s
None ADMET Activity nan None 10.1021/jm2001103
None No relevant target Dissociation constant 6.82 None 10.1021/jm00178a008
None No relevant target Kd 200000000.0 nM 10.1021/jm000017s
None No relevant target pKa 6.71 None 10.1021/jm00226a007
None No relevant target pKa 6.71 None 10.1021/jm2001103
None No relevant target pKa 6.86 None 10.1021/acs.jmedchem.2c01166
None No relevant target pKa 6.86 None 10.1021/jm049533z
None No relevant target pKa 7.0 None 10.1016/j.bmcl.2004.02.011
None No relevant target pKA -7.6 None 10.1016/S0960-894X(01)80427-3
None Nucleic Acid IC50 20000000.0 nM 10.1016/j.bmcl.2014.11.004
None Unchecked Ratio CC50/EC50 10.0 None 10.1021/jm2001103
None Unchecked Ratio IC50 0.8 None 10.1021/jm900380j
None Unchecked Ratio IC50 1.1 None 10.1021/jm900380j

Metabolism Information