717

Source:http://linkedlifedata.com/resource/chembl/compound/717

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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:717_Bicalutamide_INN, synonym:717_Calutide_TRADE_NAME, synonym:717_Casodex_OTHER, synonym:717_Casodex_TRADE_NAME, synonym:717_Cosudex_TRADE_NAME, synonym:717_Kalumid_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C18H14F4N2O4S/c1-17(26,10-29(27,28)14-6-3-12(19)4-7-14)16(25)24-13-5-2-11(9-23)15(8-13)18(20,21)22/h2-8,26H,10H2,1H3,(H,24,25)
chemicalCompound:standardIn...	LKJPYSCBVHEWIU-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(O)(CS(=O)(=O)c1ccc(F)cc1)C(=O)Nc2ccc(C#N)c(c2)C(F)(F)F
chemicalCompound:molecularF...	C18H14F4N2O4S
chemicalCompound:moleculeId	717
chemicalCompound:mwFreebase	430.373
chemicalCompound:alogp	2.926
chemicalCompound:hba	5
chemicalCompound:hbd	2
chemicalCompound:psa	115.64
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	11.492
chemicalCompound:acdLogP	4.135
chemicalCompound:acdLogD	4.135
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	430.373
chemicalCompound:chemblId	CHEMBL409
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:100717
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	BICALUTAMIDE
chemicalCompound:firstAppro...	1995
chemicalCompound:activity	activity:276501, activity:276502, activity:276503, activity:276504, activity:276505, activity:377959, activity:377960, activity:377961, activity:377962, activity:377963, activity:377964, activity:377965, activity:431169, activity:431170, activity:431171, activity:525156, activity:525157, activity:525158, activity:525159, activity:525160, activity:528691, activity:528692, activity:528693, activity:528694, activity:528695, activity:928195, activity:928196, activity:928197, activity:1139501, activity:1287788, activity:1287789, activity:1287790, activity:1287791, activity:1422155, activity:1422156, activity:1422157, activity:1422158, activity:1422159, activity:1436712, activity:1436713, activity:1436714, activity:1436715, activity:1436716, activity:1462706, activity:1462707, activity:1462708, activity:1504612, activity:1504613, activity:1504730, activity:1504731, activity:1504732, activity:1673717, activity:1673718, activity:1673719, activity:1673720, activity:1673721, activity:1673722, activity:1673723, activity:1673724