549698

Source:http://linkedlifedata.com/resource/chembl/compound/549698

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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:1325
chemicalCompound:synonym	synonym:549698_Stelazine_TRADE_NAME, synonym:549698_Trifluoperazine Hydrochloride_JAN, synonym:549698_Trifluoperazine Hydrochloride_USAN, synonym:549698_Trifluoperazine Hydrochloride_USP, synonym:549698_Trifluoperazine Maleate_JAN, synonym:549698_Trifluoperazine hydrochloride_FDA_ALTERNATIVE_NAME, synonym:549698_Trifluoperazine hydrochloride_TRADE_NAME, synonym:549698_Trifluoperazine_BAN, synonym:549698_Trifluoperazine_INN
chemicalCompound:standardIn...	InChI=1S/C21H24F3N3S.ClH/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24;/h2-3,5-8,15H,4,9-14H2,1H3;1H
chemicalCompound:standardIn...	RIULCFSTKRDHBX-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.CN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1
chemicalCompound:molecularF...	C21H25ClF3N3S
chemicalCompound:moleculeId	549698
chemicalCompound:mwFreebase	407.496
chemicalCompound:alogp	4.975
chemicalCompound:hba	4
chemicalCompound:hbd	0
chemicalCompound:psa	35.02
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.62
chemicalCompound:acdLogD	4.016
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	443.957
chemicalCompound:acdMostBpk...	7.655
chemicalCompound:chemblId	CHEMBL1710
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:649698
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	TRIFLUOPERAZINE HYDROCHLORIDE
chemicalCompound:activity	activity:1962713, activity:1962750, activity:1962787, activity:1962824, activity:1962861, activity:1962899, activity:1962936, activity:3473277, activity:3665776, activity:3745403, activity:3755126, activity:3840990, activity:3957547, activity:3971675, activity:4008270, activity:4052927, activity:4063507, activity:4114031, activity:4370772, activity:4372506, activity:4375853, activity:4405166, activity:4416332, activity:4570239, activity:4580628, activity:4639647, activity:4721810, activity:4759228, activity:4874370, activity:4917345, activity:4920136, activity:4921014, activity:5000923, activity:5012416, activity:5020642, activity:5027771, activity:5340977, activity:5343751, activity:5393149, activity:5502373, activity:5598778, activity:5719448, activity:5726285, activity:5814046, activity:5819605, activity:6528766, activity:6912579, activity:6998016, activity:7133852, activity:7281503, activity:7368989, activity:7440692, activity:7463551, activity:7507729, activity:7516156, activity:7544784