DK1

5,7-DICHLORO-4-HYDROXYQUINOLINE-2-CARBOXYLIC ACID

Created:	2003-06-03
Last modified:	2020-05-27

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1 entries where DK1 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	21
Chiral Atom Count	0
Bond Count	22
Aromatic Bond Count	11

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Chemical Component Summary
Name	5,7-DICHLORO-4-HYDROXYQUINOLINE-2-CARBOXYLIC ACID
Synonyms	DCKA; 5,7-DICHLOROKYNURENIC ACID
Systematic Name (OpenEye OEToolkits)	5,7-dichloro-4-hydroxy-quinoline-2-carboxylic acid
Formula	C₁₀ H₅ Cl₂ N O₃
Molecular Weight	258.058
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	Clc1cc2nc(cc(O)c2c(Cl)c1)C(=O)O
SMILES	CACTVS	3.341	OC(=O)c1cc(O)c2c(Cl)cc(Cl)cc2n1
SMILES	OpenEye OEToolkits	1.5.0	c1c(cc(c2c1nc(cc2O)C(=O)O)Cl)Cl
Canonical SMILES	CACTVS	3.341	OC(=O)c1cc(O)c2c(Cl)cc(Cl)cc2n1
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1c(cc(c2c1nc(cc2O)C(=O)O)Cl)Cl
InChI	InChI	1.03	InChI=1S/C10H5Cl2NO3/c11-4-1-5(12)9-6(2-4)13-7(10(15)16)3-8(9)14/h1-3H,(H,13,14)(H,15,16)
InChIKey	InChI	1.03	BGKFPRIGXAVYNX-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB01931
Name	5,7-Dichlorokynurenic acid
Groups	experimental
Synonyms	5,7-Dcka 5,7-Dichlorokynurenic acid 5,7-Dichloroquinurenic acid 5,7-Dichorokynurenic acid
Categories	Excitatory Amino Acid Agents Excitatory Amino Acid Antagonists Heterocyclic Compounds, Fused-Ring Hydroxyquinolines Neurotransmitter Agents Quinolines Xanthurenates
CAS number	131123-76-7

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Glutamate receptor ionotropic, NMDA 1	MSTMRLLTLALLFSCSVARAACDPKIVNIGAVLSTRKHEQMFREAVNQAN...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682