674283

Source:http://linkedlifedata.com/resource/chembl/compound/674283

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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:28112
chemicalCompound:synonym	synonym:674283_MK-240_RESEARCH_CODE, synonym:674283_Protriptyline Hydrochloride_USAN, synonym:674283_Protriptyline_BAN, synonym:674283_Protriptyline_INN
chemicalCompound:standardIn...	InChI=1S/C19H21N.ClH/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19;/h2-5,7-10,12-13,19-20H,6,11,14H2,1H3;1H
chemicalCompound:standardIn...	OGQDIIKRQRZXJH-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.CNCCCC1c2ccccc2C=Cc3ccccc13
chemicalCompound:molecularF...	C19H22ClN
chemicalCompound:moleculeId	674283
chemicalCompound:mwFreebase	263.377
chemicalCompound:alogp	4.041
chemicalCompound:hba	1
chemicalCompound:hbd	1
chemicalCompound:psa	12.03
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.36
chemicalCompound:acdLogD	1.509
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	299.838
chemicalCompound:acdMostBpk...	10.611
chemicalCompound:chemblId	CHEMBL1200332
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:774283
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	Yes
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	PROTRIPTYLINE HYDROCHLORIDE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:8598
chemicalCompound:activity	activity:3473260, activity:3481287, activity:3484641, activity:3484727, activity:3484813, activity:3484872, activity:3484960, activity:3485746, activity:3635031, activity:3695185, activity:3707111, activity:3723972, activity:3780168, activity:3887731, activity:3897162, activity:3940488, activity:3988077, activity:4084725, activity:4278532, activity:4358351, activity:4417117, activity:4535843, activity:4538207, activity:4565462, activity:4631653, activity:4966382, activity:4996880, activity:5012075, activity:5614298, activity:5702094, activity:5727959, activity:5875700, activity:6549901, activity:6999636, activity:7008938, activity:7066442, activity:7193177, activity:7339547, activity:7341934, activity:7435347, activity:7487086, activity:7520485