366777

Source:http://linkedlifedata.com/resource/chembl/compound/366777

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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/C23H21F3N2O4S/c1-13-18(33-20(28-13)16-6-4-5-7-17(16)23(24,25)26)19(29)27-12-14-8-10-15(11-9-14)32-22(2,3)21(30)31/h4-11H,12H2,1-3H3,(H,27,29)(H,30,31)
chemicalCompound:standardIn...	CBLOILAXMBDKEP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1nc(sc1C(=O)NCc2ccc(OC(C)(C)C(=O)O)cc2)c3ccccc3C(F)(F)F
chemicalCompound:molecularF...	C23 H21 F3 N2 O4 S
chemicalCompound:moleculeId	366777
chemicalCompound:mwFreebase	478.484
chemicalCompound:alogp	4.779
chemicalCompound:hba	5
chemicalCompound:hbd	2
chemicalCompound:psa	116.76
chemicalCompound:rtb	8
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	3.244
chemicalCompound:acdLogP	3.03
chemicalCompound:acdLogD	-0.579
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	478.484
chemicalCompound:acdMostBpk...	0.948
chemicalCompound:chemblId	CHEMBL375761
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:466777
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:1814042, activity:1814060, activity:1814077, activity:1814093, activity:1814103