242255

Source:http://linkedlifedata.com/resource/chembl/compound/242255

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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/C24H32ClN3O4S/c1-24(2,3)32-23(29)27-13-14-31-20-10-7-18(15-21(20)30-4)16-28-22(33)26-12-11-17-5-8-19(25)9-6-17/h5-10,15H,11-14,16H2,1-4H3,(H,27,29)(H2,26,28,33)
chemicalCompound:standardIn...	OFLZCEMLXWIEMP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COc1cc(C\N=C(/S)\NCCc2ccc(Cl)cc2)ccc1OCCNC(=O)OC(C)(C)C
chemicalCompound:molecularF...	C24 H32 Cl N3 O4 S
chemicalCompound:moleculeId	242255
chemicalCompound:mwFreebase	494.047
chemicalCompound:alogp	5.54
chemicalCompound:hba	7
chemicalCompound:hbd	3
chemicalCompound:psa	119.98
chemicalCompound:rtb	13
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	12.108
chemicalCompound:acdLogP	5.28
chemicalCompound:acdLogD	2.78
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	494.047
chemicalCompound:acdMostBpk...	14.565
chemicalCompound:chemblId	CHEMBL359189
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:342255
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:960139