607081

Source:http://linkedlifedata.com/resource/chembl/compound/607081

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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/C16H24N4O6/c1-3-5-18-13-10(14(24)19(6-4-2)16(18)25)20(8-17-13)15-12(23)11(22)9(7-21)26-15/h8-9,11-12,15,21-23H,3-7H2,1-2H3/t9-,11-,12-,15?/m1/s1
chemicalCompound:standardIn...	KVOVXTNYWRLQGE-FJFSNTMWSA-N
chemicalCompound:canonicalS...	CCCN1C(=O)N(CCC)c2ncn(C3O[C@H](CO)[C@@H](O)[C@H]3O)c2C1=O
chemicalCompound:molecularF...	C16H24N4O6
chemicalCompound:moleculeId	607081
chemicalCompound:mwFreebase	368.385
chemicalCompound:alogp	0
chemicalCompound:hba	7
chemicalCompound:hbd	3
chemicalCompound:psa	128.36
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	13.223
chemicalCompound:acdLogP	0.207
chemicalCompound:acdLogD	0.207
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	368.385
chemicalCompound:chemblId	CHEMBL610702
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:707081
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:451655, activity:451656, activity:451657, activity:451658, activity:451659