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Daminozide

AlkaPlorer ID: AK048808

Synonym: None

IUPAC Name: 4-(2,2-dimethylhydrazinyl)-4-oxobutanoic acid

Structure

SMILES: CN(C)N=C(O)CCC(=O)O

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InChI: InChI=1S/C6H12N2O3/c1-8(2)7-5(9)3-4-6(10)11/h3-4H2,1-2H3,(H,7,9)(H,10,11)

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InChIKey: NOQGZXFMHARMLW-UHFFFAOYSA-N

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Reference

PubChem CID: 72200802

CAS: 1596-84-5

SuperNatural Ⅲ: SN0251191

NPASS: NPC43264

COCONUT: CNP0273846

Properties Information

Molecule Weight: 160.173

TPSA？: 73.13

MolLogP？: 0.2842999999999999

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens DNA-(apurinic or apyrimidinic site) lyase Potency 794.3 nM None
Homo sapiens Egl nine homolog 1 IC50 100000.0 nM 10.1021/jm300677j
Homo sapiens Gamma-butyrobetaine dioxygenase IC50 100000.0 nM 10.1021/jm300677j
Homo sapiens Histone deacetylase 6 Inhibition -17.99 % 10.6019/CHEMBL4808148
Homo sapiens Histone deacetylase 6 Inhibition -1.94 % 10.6019/CHEMBL4808148
Homo sapiens Histone lysine demethylase PHF8 IC50 550.0 nM 10.1021/jm300677j
Homo sapiens Histone lysine demethylase PHF8 IC50 550.0 nM 10.1021/jm400624b
Homo sapiens Histone lysine demethylase PHF8 IC50 19000.0 nM 10.1021/jm400624b
Homo sapiens Hypoxia-inducible factor 1-alpha inhibitor IC50 100000.0 nM 10.1021/jm300677j
Homo sapiens Lysine-specific demethylase 2A IC50 1500.0 nM 10.1021/jm300677j
Homo sapiens Lysine-specific demethylase 2A IC50 1500.0 nM 10.1021/jm400624b
Homo sapiens Lysine-specific demethylase 2A Ki 1970.0 nM 10.1021/jm300677j
Homo sapiens Lysine-specific demethylase 2A Ki 85000.0 nM 10.1021/jm300677j
Homo sapiens Lysine-specific demethylase 4A IC50 3300000.0 nM 10.1021/jm400624b
Homo sapiens Lysine-specific demethylase 4C IC50 2500000.0 nM 10.1021/jm400624b
Homo sapiens Lysine-specific demethylase 4D-like IC50 100000.0 nM 10.1021/jm300677j
Homo sapiens Lysine-specific demethylase 5A IC50 2200000.0 nM 10.1021/jm400624b
Homo sapiens Lysine-specific demethylase 5C IC50 100000.0 nM 10.1021/jm300677j
Homo sapiens Lysine-specific demethylase 6A IC50 100000.0 nM 10.1021/jm400624b
Homo sapiens Lysine-specific demethylase 6B IC50 100000.0 nM 10.1021/jm300677j
Homo sapiens Lysine-specific demethylase 7 IC50 2100.0 nM 10.1021/jm300677j
Paramecium bursaria Chlorella virus 1 Prolyl 4-hydroxylase IC50 100000.0 nM 10.1016/j.bmc.2019.01.018
Severe acute respiratory syndrome coronavirus 2 Replicase polyprotein 1ab Inhibition 23.94 % 10.6019/CHEMBL4495564
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 Inhibition -4.94 % 10.21203/rs.3.rs-23951/v1
Severe acute respiratory syndrome coronavirus 2 SARS-CoV-2 Inhibition 0.33 % 10.6019/CHEMBL4495565
None Molecular identity unknown Potency 31622.8 nM None
None NON-PROTEIN TARGET Potency 0.7 nM None
None NON-PROTEIN TARGET Potency 167.7 nM None
None NON-PROTEIN TARGET Potency 1882.1 nM None
None NON-PROTEIN TARGET Potency 9432.9 nM None
None Unchecked IC50 127000.0 nM 10.1021/jm300677j
None Unchecked Ratio IC50 60.0 None 10.1021/jm300677j

Metabolism Information