470800

Source:http://linkedlifedata.com/resource/chembl/compound/470800

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:422253
chemicalCompound:synonym	synonym:470800_Isentress_TRADE_NAME, synonym:470800_Raltegravir Potassium_USAN, synonym:470800_Raltegravir potassium_OTHER
chemicalCompound:standardIn...	InChI=1S/C20H21FN6O5.K/c1-10-25-26-17(32-10)16(30)24-20(2,3)19-23-13(14(28)18(31)27(19)4)15(29)22-9-11-5-7-12(21)8-6-11;/h5-8,28H,9H2,1-4H3,(H,22,29)(H,24,30);/q;+1/p-1
chemicalCompound:standardIn...	IFUKBHBISRAZTF-UHFFFAOYSA-M
chemicalCompound:canonicalS...	[K+].CN1C(=O)C(=C(N=C1C(C)(C)NC(=O)c2oc(C)nn2)C(=O)NCc3ccc(F)cc3)[O-]
chemicalCompound:molecularF...	C20H20FKN6O5
chemicalCompound:moleculeId	470800
chemicalCompound:mwFreebase	444.416
chemicalCompound:alogp	-0.291
chemicalCompound:hba	7
chemicalCompound:hbd	3
chemicalCompound:psa	150.01
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	4.5
chemicalCompound:acdLogP	2.715
chemicalCompound:acdLogD	-0.088
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	482.507
chemicalCompound:acdMostBpk...	0.417
chemicalCompound:chemblId	CHEMBL518520
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:570800
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	RALTEGRAVIR POTASSIUM
chemicalCompound:firstAppro...	2007
chemicalCompound:activity	activity:2360997, activity:2360998, activity:2360999, activity:2361000, activity:2361001, activity:2361002, activity:2361003, activity:2361004, activity:2361005, activity:2361006, activity:2361007, activity:2361008, activity:2361032, activity:2361033, activity:2361034, activity:2691736, activity:2691737, activity:2691738, activity:3497530, activity:3497565, activity:3497581, activity:5305942, activity:5305943, activity:5305944, activity:5305945, activity:5305946, activity:5305947, activity:5305948, activity:5305949, activity:5305950, activity:5305951, activity:5305952, activity:5305953, activity:5305954, activity:5305955, activity:5305956, activity:5305957, activity:5305958, activity:5305959, activity:5305960, activity:5305961, activity:5305962, activity:5305963, activity:5305964, activity:5305965, activity:5305966, activity:5305967, activity:5305968, activity:5305969, activity:5305970, activity:5305971, activity:5305972, activity:5305973, activity:5305974, activity:5305975, activity:5305976, activity:5305977, activity:5305978, activity:5305979, activity:5305980