549

Source:http://linkedlifedata.com/resource/chembl/compound/549

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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:549_FUDR_TRADE_NAME, synonym:549_Floxuridine_OTHER
chemicalCompound:standardIn...	InChI=1S/C9H11FN2O5/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7/h2,5-7,13-14H,1,3H2,(H,11,15,16)
chemicalCompound:standardIn...	ODKNJVUHOIMIIZ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	OCC1OC(CC1O)N2C=C(F)C(=O)NC2=O
chemicalCompound:molecularF...	C9 H11 F N2 O5
chemicalCompound:moleculeId	549
chemicalCompound:mwFreebase	246.192
chemicalCompound:alogp	-1.775
chemicalCompound:hba	5
chemicalCompound:hbd	3
chemicalCompound:psa	99.1
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	7.628
chemicalCompound:acdLogP	-1.413
chemicalCompound:acdLogD	-1.628
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	246.192
chemicalCompound:chemblId	CHEMBL6628
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:100549
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	5-FLUORODEOXYURIDINE
chemicalCompound:activity	activity:119553, activity:119554, activity:119555, activity:119556, activity:119557, activity:119558, activity:148729, activity:148730, activity:148731, activity:148732, activity:148733, activity:148734, activity:148735, activity:148736, activity:148737, activity:148738, activity:148739, activity:148740, activity:148741, activity:148742, activity:148743, activity:148744, activity:148745, activity:148746, activity:162402, activity:162403, activity:162404, activity:162405, activity:162406, activity:187949, activity:187950, activity:201048, activity:201049, activity:201050, activity:201051, activity:201052, activity:201053, activity:201054, activity:201055, activity:201056, activity:201057, activity:201058, activity:272003, activity:272004, activity:272005, activity:272006, activity:272007, activity:272008, activity:272009, activity:272010, activity:272011, activity:272012, activity:338541, activity:338542, activity:338543, activity:338544, activity:338545, activity:338546, activity:338547, activity:338548, activity:345192, activity:379495, activity:379496, activity:379497