240769

Source:http://linkedlifedata.com/resource/chembl/compound/240769

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:240769_Citric Acid_JAN, synonym:240769_Citric Acid_USAN, synonym:240769_Citric Acid_USP, synonym:240769_Citric acid_FDA_ALTERNATIVE_NAME, synonym:240769_Urologic G_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
chemicalCompound:standardIn...	KRKNYBCHXYNGOX-UHFFFAOYSA-N
chemicalCompound:canonicalS...	OC(=O)CC(O)(CC(=O)O)C(=O)O
chemicalCompound:molecularF...	C6H8O7
chemicalCompound:moleculeId	240769
chemicalCompound:mwFreebase	192.124
chemicalCompound:alogp	-1.319
chemicalCompound:hba	7
chemicalCompound:hbd	4
chemicalCompound:psa	132.13
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	2.926
chemicalCompound:acdLogP	-1.198
chemicalCompound:acdLogD	-6.933
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	192.124
chemicalCompound:chemblId	CHEMBL1261
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:340769
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	Yes
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	CITRIC ACID
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:30769
chemicalCompound:firstAppro...	1982
chemicalCompound:activity	activity:203412, activity:453201, activity:792365, activity:792366, activity:1681145, activity:1681148, activity:1681699, activity:2426144, activity:2426149, activity:2444642, activity:2444644, activity:2644855, activity:2997996, activity:3059247, activity:3774797, activity:3951343, activity:4176411, activity:4291461, activity:4674445, activity:4896416, activity:4901604, activity:4976500, activity:4980658, activity:5317227, activity:5318178, activity:5319129, activity:5359221, activity:6584716, activity:6750474, activity:6750570, activity:7047036, activity:7048587, activity:7457971, activity:7695173, activity:7695174, activity:7695175, activity:7695176, activity:7695177, activity:7695178, activity:7695179, activity:7695180, activity:7695181, activity:7695182, activity:7695183, activity:7695184, activity:7695185, activity:7695186, activity:7695187, activity:7695188, activity:7695189, activity:7695190, activity:7695191, activity:7695192, activity:7695193, activity:7697224, activity:7697225, activity:7697226, activity:7697227, activity:7697228