4634

Source:http://linkedlifedata.com/resource/chembl/compound/4634

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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:4634_SPIPERONE_TRADE_NAME, synonym:4634_SPIROPERIDOL_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C23H26FN3O2/c24-19-10-8-18(9-11-19)21(28)7-4-14-26-15-12-23(13-16-26)22(29)25-17-27(23)20-5-2-1-3-6-20/h1-3,5-6,8-11H,4,7,12-17H2,(H,25,29)
chemicalCompound:standardIn...	DKGZKTPJOSAWFA-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Fc1ccc(cc1)C(=O)CCCN2CCC3(CC2)N(CNC3=O)c4ccccc4
chemicalCompound:molecularF...	C23H26FN3O2
chemicalCompound:moleculeId	4634
chemicalCompound:mwFreebase	395.47
chemicalCompound:alogp	3.064
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	52.65
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.248
chemicalCompound:acdLogD	1.76
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	395.47
chemicalCompound:acdMostBpk...	8.888
chemicalCompound:chemblId	CHEMBL267930
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:104634
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	SPIPERONE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:9233
chemicalCompound:activity	activity:78595, activity:78596, activity:78597, activity:95640, activity:95641, activity:95642, activity:95643, activity:95644, activity:95645, activity:95646, activity:95647, activity:144557, activity:162077, activity:162078, activity:192223, activity:202174, activity:223993, activity:223994, activity:223995, activity:223996, activity:223997, activity:223998, activity:223999, activity:262826, activity:262827, activity:262828, activity:262829, activity:262830, activity:324219, activity:324220, activity:384870, activity:384871, activity:384872, activity:384873, activity:385046, activity:385047, activity:423069, activity:473086, activity:473087, activity:473088, activity:494911, activity:494912, activity:494913, activity:568232, activity:589977, activity:589978, activity:589979, activity:589980, activity:599860, activity:599861, activity:599862, activity:694985, activity:700946, activity:725740, activity:738351, activity:757499, activity:757500, activity:822303, activity:899557, activity:899558, activity:899559, activity:899560, activity:929568