74666

Source:http://linkedlifedata.com/resource/chembl/compound/74666

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C21H19N3/c1-2-24-20-13-16(23)9-11-18(20)17-10-8-15(22)12-19(17)21(24)14-6-4-3-5-7-14/h3-13,23H,2,22H2,1H3/p+1
chemicalCompound:standardIn...	QTANTQQOYSUMLC-UHFFFAOYSA-O
chemicalCompound:canonicalS...	CC[n+]1c(c2ccccc2)c3cc(N)ccc3c4ccc(N)cc14
chemicalCompound:molecularF...	C21H20N3
chemicalCompound:moleculeId	74666
chemicalCompound:mwFreebase	314.404
chemicalCompound:alogp	4.208
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	55.92
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	-0.597
chemicalCompound:acdLogD	-0.597
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	314.404
chemicalCompound:acdMostBpk...	1.668
chemicalCompound:chemblId	CHEMBL48166
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:174666
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	ETHIDIUM
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:42478
chemicalCompound:activity	activity:3660042, activity:3694267, activity:3777251, activity:4005667, activity:4038893, activity:4088924, activity:4175310, activity:4505410, activity:4597799, activity:4836243, activity:4933924, activity:4962735, activity:5521209, activity:5721877, activity:5961940, activity:6427851, activity:6894479, activity:6930323, activity:7052023, activity:7074333, activity:7302674