227917

Source:http://linkedlifedata.com/resource/chembl/compound/227917

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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:227917_Oxazolidin_OTHER, synonym:227917_Oxiphenbutazone_OTHER, synonym:227917_Oxyphenbutazone_BAN, synonym:227917_Oxyphenbutazone_FDA_ALTERNATIVE_NAME, synonym:227917_Oxyphenbutazone_INN, synonym:227917_Oxyphenbutazone_TRADE_NAME, synonym:227917_Oxyphenbutazone_USAN, synonym:227917_Oxyphenbutazone_USP, synonym:227917_Tandearil_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C19H20N2O3/c1-2-3-9-17-18(23)20(14-7-5-4-6-8-14)21(19(17)24)15-10-12-16(22)13-11-15/h4-8,10-13,17,22H,2-3,9H2,1H3
chemicalCompound:standardIn...	HFHZKZSRXITVMK-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCC1C(=O)N(N(C1=O)c2ccc(O)cc2)c3ccccc3
chemicalCompound:molecularF...	C19H20N2O3
chemicalCompound:moleculeId	227917
chemicalCompound:mwFreebase	324.374
chemicalCompound:alogp	3.712
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	60.85
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	5.079
chemicalCompound:acdLogP	2.74
chemicalCompound:acdLogD	0.469
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	324.374
chemicalCompound:acdMostBpk...	0.224
chemicalCompound:chemblId	CHEMBL1228
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:327917
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	OXYPHENBUTAZONE
chemicalCompound:firstAppro...	1982
chemicalCompound:activity	activity:71363, activity:3254593, activity:3254594, activity:3254595, activity:3254596, activity:3391332, activity:3391333, activity:3391334, activity:3391335, activity:3391336, activity:3391337, activity:3391338, activity:3391339, activity:3391340, activity:3391341, activity:3391342, activity:3391343, activity:3391344, activity:3391345, activity:3391346, activity:3391347, activity:3772748, activity:3776281, activity:3849821, activity:4049053, activity:4089367, activity:4154962, activity:4248741, activity:4309624, activity:4507383, activity:4595141, activity:4685015, activity:4780507, activity:4815234, activity:4830346, activity:4969686, activity:5029296, activity:5038739, activity:5317692, activity:5318643, activity:5319594, activity:5350939, activity:5402390, activity:5477756, activity:5504450, activity:5672607, activity:5753448, activity:5937589, activity:6439041, activity:6444607, activity:6495812, activity:6643583, activity:6761831, activity:6774550, activity:6827855