674661

Source:http://linkedlifedata.com/resource/chembl/compound/674661

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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:996
chemicalCompound:synonym	synonym:674661_Anafranil_TRADE_NAME, synonym:674661_Chlorimipramine_TRADE_NAME, synonym:674661_Clomipramine Hydrochloride_JAN, synonym:674661_Clomipramine Hydrochloride_USAN, synonym:674661_Clomipramine_BAN, synonym:674661_Clomipramine_INN, synonym:674661_G-34586_RESEARCH_CODE
chemicalCompound:standardIn...	InChI=1S/C19H23ClN2.ClH/c1-21(2)12-5-13-22-18-7-4-3-6-15(18)8-9-16-10-11-17(20)14-19(16)22;/h3-4,6-7,10-11,14H,5,8-9,12-13H2,1-2H3;1H
chemicalCompound:standardIn...	WIMWMKZEIBHDTH-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.CN(C)CCCN1c2ccccc2CCc3ccc(Cl)cc13
chemicalCompound:molecularF...	C19H24Cl2N2
chemicalCompound:moleculeId	674661
chemicalCompound:mwFreebase	314.852
chemicalCompound:alogp	5.052
chemicalCompound:hba	2
chemicalCompound:hbd	0
chemicalCompound:psa	6.48
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.94
chemicalCompound:acdLogD	2.952
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	351.313
chemicalCompound:acdMostBpk...	9.463
chemicalCompound:chemblId	CHEMBL1200710
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:774661
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	CLOMIPRAMINE HYDROCHLORIDE
chemicalCompound:firstAppro...	1989
chemicalCompound:activity	activity:3473367, activity:3485840, activity:3485841, activity:3485842, activity:3485843, activity:3485844, activity:3485845, activity:3485846, activity:3625908, activity:3635134, activity:3654158, activity:3696361, activity:3702517, activity:3872477, activity:3885472, activity:3897349, activity:3941379, activity:3954260, activity:3974158, activity:4007300, activity:4019009, activity:4029872, activity:4279457, activity:4358711, activity:4402548, activity:4403377, activity:4409032, activity:4437392, activity:4453600, activity:4532351, activity:4536226, activity:4539049, activity:4571360, activity:4690259, activity:4805411, activity:4834402, activity:4909401, activity:4970550, activity:4992610, activity:4996328, activity:5010263, activity:5018935, activity:5078677, activity:5334349, activity:5609134, activity:5697457, activity:5738310, activity:5832882, activity:5851062, activity:5855623, activity:5875720, activity:5980688, activity:6587700, activity:6835784, activity:7002944, activity:7008957, activity:7193478