911001

Source:http://linkedlifedata.com/resource/chembl/compound/911001

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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/C20H28N6S/c1-13-12-14(2)26(24-13)20-22-18(21-10-7-11-25(3)4)17-15-8-5-6-9-16(15)27-19(17)23-20/h12H,5-11H2,1-4H3,(H,21,22,23)
chemicalCompound:standardIn...	OBYWVKBVUSCYQS-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CN(C)CCCNc1nc(nc2sc3CCCCc3c12)n4nc(C)cc4C
chemicalCompound:molecularF...	C20H28N6S
chemicalCompound:moleculeId	911001
chemicalCompound:mwFreebase	384.542
chemicalCompound:alogp	3.747
chemicalCompound:hba	5
chemicalCompound:hbd	1
chemicalCompound:psa	87.1
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.683
chemicalCompound:acdLogD	2.653
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	384.542
chemicalCompound:acdMostBpk...	9.46
chemicalCompound:chemblId	CHEMBL1487117
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1011001
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:3802895, activity:4009175, activity:4080680, activity:4813483, activity:4847319, activity:4974588, activity:5574317, activity:6733506, activity:6894250, activity:7029997, activity:7165328, activity:7305045, activity:7362940, activity:7505166