706035

Source:http://linkedlifedata.com/resource/chembl/compound/706035

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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:standardIn...	InChI=1S/C21H24F3N3S.2ClH/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;2*1H
chemicalCompound:standardIn...	BXDAOUXDMHXPDI-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.Cl.CN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1
chemicalCompound:molecularF...	C21H26Cl2F3N3S
chemicalCompound:moleculeId	706035
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	480.417
chemicalCompound:acdMostBpk...	7.655
chemicalCompound:chemblId	CHEMBL1257040
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:806035
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	TRIFLUOPERAZINE DIHYDROCHLORIDE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:9710
chemicalCompound:activity	activity:3481333, activity:3481383, activity:3481551, activity:3481597, activity:3482342, activity:3482388, activity:3482427, activity:3636043, activity:3664928, activity:3697243, activity:3885103, activity:3928518, activity:3941405, activity:3971509, activity:3974232, activity:4064732, activity:4069671, activity:4194643, activity:4279521, activity:4358772, activity:4403403, activity:4411808, activity:4441233, activity:4536289, activity:4539090, activity:4571835, activity:4711758, activity:4729768, activity:4929303, activity:4961518, activity:4974388, activity:5030767, activity:5041308, activity:5065176, activity:5341167, activity:5570953, activity:5737878, activity:5856543, activity:5863802, activity:5875841, activity:6446574, activity:6798484, activity:7012613, activity:7351336, activity:7443987, activity:7464177, activity:7470135, activity:7553780