1288202

Source:http://linkedlifedata.com/resource/chembl/compound/1288202

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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/C11H17ClN4O2/c12-8-7(4-17)9(16-10(13)15-8)14-5-11(6-18)2-1-3-11/h17-18H,1-6H2,(H3,13,14,15,16)
chemicalCompound:standardIn...	ZLYIJMADYJWPRM-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Nc1nc(Cl)c(CO)c(NCC2(CO)CCC2)n1
chemicalCompound:molecularF...	C11H17ClN4O2
chemicalCompound:moleculeId	1288202
chemicalCompound:mwFreebase	272.731
chemicalCompound:alogp	0.901
chemicalCompound:hba	6
chemicalCompound:hbd	4
chemicalCompound:psa	104.29
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	12.584
chemicalCompound:acdLogP	0.489
chemicalCompound:acdLogD	0.489
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	272.731
chemicalCompound:acdMostBpk...	3.418
chemicalCompound:chemblId	CHEMBL1966911
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1388202
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:8265813, activity:8267616, activity:8321521, activity:8336725, activity:8422293, activity:8438144, activity:8457646, activity:8495409, activity:8522444, activity:8537952, activity:8618760, activity:8675098, activity:8695308, activity:8790322, activity:8792958, activity:8823029, activity:8866151, activity:8874824, activity:8925698, activity:8989014, activity:9012149, activity:9022268, activity:9112682, activity:9119206, activity:9206420, activity:9239231, activity:9250067, activity:9324476, activity:9388491, activity:9460942, activity:9467911, activity:9530214, activity:9723295, activity:9733945, activity:9813118, activity:9839307, activity:9884897, activity:9914988, activity:9943424, activity:9983290, activity:10042074, activity:10119534, activity:10234899, activity:10274348, activity:10285505, activity:10390276, activity:10410933, activity:10459725, activity:10515866, activity:10544340, activity:10624101, activity:10638921, activity:10722229, activity:10738085, activity:10745209