255355

Source:http://linkedlifedata.com/resource/chembl/compound/255355

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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/C24H18ClF4N5O4/c1-30-20-19-21(33-24(25)32-20)34(11-31-19)8-12(9-37-22(35)17-13(26)4-2-5-14(17)27)10-38-23(36)18-15(28)6-3-7-16(18)29/h2-7,11-12H,8-10H2,1H3,(H,30,32,33)
chemicalCompound:standardIn...	JTTYPOMTAHXWSX-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CNc1nc(Cl)nc2c1ncn2CC(COC(=O)c3c(F)cccc3F)COC(=O)c4c(F)cccc4F
chemicalCompound:molecularF...	C24 H18 Cl F4 N5 O4
chemicalCompound:moleculeId	255355
chemicalCompound:mwFreebase	551.877
chemicalCompound:alogp	4.589
chemicalCompound:hba	8
chemicalCompound:hbd	1
chemicalCompound:psa	108.22
chemicalCompound:rtb	11
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.752
chemicalCompound:acdLogD	4.752
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	551.877
chemicalCompound:acdMostBpk...	1.515
chemicalCompound:chemblId	CHEMBL156840
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:355355
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:458667