674852

Source:http://linkedlifedata.com/resource/chembl/compound/674852

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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:152728
chemicalCompound:synonym	synonym:674852_Halofantrine Hydrochloride_USAN, synonym:674852_Halofantrine_BAN, synonym:674852_Halofantrine_INN, synonym:674852_WR-171669_RESEARCH_CODE
chemicalCompound:standardIn...	InChI=1S/C26H30Cl2F3NO.ClH/c1-3-5-10-32(11-6-4-2)12-9-25(33)23-16-22-21(14-18(27)15-24(22)28)20-13-17(26(29,30)31)7-8-19(20)23;/h7-8,13-16,25,33H,3-6,9-12H2,1-2H3;1H
chemicalCompound:standardIn...	WANGFTDWOFGECH-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.CCCCN(CCCC)CCC(O)c1cc2c(Cl)cc(Cl)cc2c3cc(ccc13)C(F)(F)F
chemicalCompound:molecularF...	C26H31Cl3F3NO
chemicalCompound:moleculeId	674852
chemicalCompound:mwFreebase	500.424
chemicalCompound:alogp	8.2
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	23.47
chemicalCompound:rtb	11
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	2
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	13.567
chemicalCompound:acdLogP	8.902
chemicalCompound:acdLogD	6.927
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	536.885
chemicalCompound:acdMostBpk...	9.437
chemicalCompound:chemblId	CHEMBL1200901
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:774852
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	HALOFANTRINE HYDROCHLORIDE
chemicalCompound:firstAppro...	1992
chemicalCompound:activity	activity:3807402, activity:3896610, activity:4285235, activity:4413086, activity:4586478, activity:4677850, activity:5343057, activity:5406773, activity:5461456, activity:5500373, activity:6665388, activity:6701486, activity:6814587, activity:6895567, activity:6965171, activity:7127538, activity:7457579, activity:7548896, activity:7560371, activity:7561953