550475

Source:http://linkedlifedata.com/resource/chembl/compound/550475

Download in:

Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:2261
chemicalCompound:synonym	synonym:550475_Azaleptin_TRADE_NAME, synonym:550475_Clopine_TRADE_NAME, synonym:550475_Clozapine_OTHER, synonym:550475_Clozaril_TRADE_NAME, synonym:550475_Denzapine_TRADE_NAME, synonym:550475_Fazaclo_TRADE_NAME, synonym:550475_Froidir_TRADE_NAME, synonym:550475_Klozapol_TRADE_NAME, synonym:550475_Leponex_TRADE_NAME, synonym:550475_Zaponex_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C18H19ClN4.ClH/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18;/h2-7,12,20H,8-11H2,1H3;1H
chemicalCompound:standardIn...	ARWPDHKDEREYEE-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.CN1CCN(CC1)C2=Nc3cc(Cl)ccc3Nc4ccccc24
chemicalCompound:molecularF...	C18H20Cl2N4
chemicalCompound:moleculeId	550475
chemicalCompound:mwFreebase	326.823
chemicalCompound:alogp	3.422
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	30.87
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.939
chemicalCompound:acdLogD	3.529
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	363.284
chemicalCompound:acdMostBpk...	7.331
chemicalCompound:chemblId	CHEMBL538973
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:650475
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	CLOZAPINE CHLORIDE
chemicalCompound:activity	activity:1000909, activity:1000910, activity:1000911, activity:1000912, activity:1000913, activity:1000914, activity:1000915, activity:1000916, activity:1000917