74911

Source:http://linkedlifedata.com/resource/chembl/compound/74911

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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:74911_BW-524W91_RESEARCH_CODE, synonym:74911_Emtricitabine_FDA_ALTERNATIVE_NAME, synonym:74911_Emtricitabine_INN, synonym:74911_Emtricitabine_USAN, synonym:74911_Emtriva_OTHER, synonym:74911_Emtriva_TRADE_NAME, synonym:74911_FTC_OTHER
chemicalCompound:standardIn...	InChI=1S/C8H10FN3O3S/c9-4-1-12(8(14)11-7(4)10)5-3-16-6(2-13)15-5/h1,5-6,13H,2-3H2,(H2,10,11,14)/t5-,6+/m0/s1
chemicalCompound:standardIn...	XQSPYNMVSIKCOC-NTSWFWBYSA-N
chemicalCompound:canonicalS...	NC1=NC(=O)N(C=C1F)[C@@H]2CS[C@H](CO)O2
chemicalCompound:molecularF...	C8H10FN3O3S
chemicalCompound:moleculeId	74911
chemicalCompound:mwFreebase	247.247
chemicalCompound:alogp	-0.68
chemicalCompound:hba	6
chemicalCompound:hbd	2
chemicalCompound:psa	113.45
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	13.827
chemicalCompound:acdLogP	-0.272
chemicalCompound:acdLogD	-0.272
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	247.247
chemicalCompound:acdMostBpk...	2.403
chemicalCompound:chemblId	CHEMBL885
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:174911
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	Yes
chemicalCompound:naturalPro...	Yes
chemicalCompound:proDrug	Yes
chemicalCompound:prefName	EMTRICITABINE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:31536
chemicalCompound:firstAppro...	2003
chemicalCompound:activity	activity:746595, activity:746596, activity:746597, activity:746598, activity:746599, activity:1178776, activity:1178777, activity:1178778, activity:2048702, activity:2060190, activity:2146746, activity:2146752, activity:2146758, activity:2146767, activity:2146773, activity:2146779, activity:2353220, activity:2353239, activity:2353258, activity:2495022, activity:2660329, activity:2660330, activity:2660331, activity:2660332, activity:2677354, activity:2677355, activity:2677356, activity:2677364, activity:2677366, activity:2677367, activity:5084705, activity:5084713, activity:5084721, activity:5084729, activity:5084737, activity:5084745, activity:5084753, activity:5084842, activity:5096444, activity:5096453, activity:5096462, activity:5096471, activity:5096480, activity:5096489, activity:5096498, activity:5096507, activity:5096516, activity:5096525, activity:5096534, activity:5096543, activity:5096552, activity:5096561, activity:5096570, activity:5116689, activity:5116690, activity:5116691