101140

Source:http://linkedlifedata.com/resource/chembl/compound/101140

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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/C24H45N6O4P/c1-19(2)11-7-5-9-14-33-35(31,34-15-10-6-8-12-20(3)4)18-32-16-13-30-17-27-21-22(25)28-24(26)29-23(21)30/h17,19-20H,5-16,18H2,1-4H3,(H4,25,26,28,29)
chemicalCompound:standardIn...	ZPPGGIQIJAEEKK-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)CCCCCOP(=O)(COCCn1cnc2c(N)nc(N)nc12)OCCCCCC(C)C
chemicalCompound:molecularF...	C24 H45 N6 O4 P
chemicalCompound:moleculeId	101140
chemicalCompound:mwFreebase	512.626
chemicalCompound:alogp	4.602
chemicalCompound:hba	9
chemicalCompound:hbd	2
chemicalCompound:psa	150.2
chemicalCompound:rtb	19
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	5.224
chemicalCompound:acdLogD	5.22
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	512.626
chemicalCompound:acdMostBpk...	5.108
chemicalCompound:chemblId	CHEMBL293418
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:201140
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:543051, activity:543052, activity:543053, activity:543054, activity:543055, activity:543056, activity:543057, activity:543058, activity:543059, activity:543060, activity:543061, activity:543062, activity:543063, activity:543064