1294433

Source:http://linkedlifedata.com/resource/chembl/compound/1294433

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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/C11H8Cl2N2O2S/c1-4(16)15-9-7-6(18-10(9)11(14)17)3-2-5(12)8(7)13/h2-3H,1H3,(H2,14,17)(H,15,16)
chemicalCompound:standardIn...	DBKQWGCVGCVPIP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(=O)Nc1c(sc2ccc(Cl)c(Cl)c12)C(=O)N
chemicalCompound:molecularF...	C11H8Cl2N2O2S
chemicalCompound:moleculeId	1294433
chemicalCompound:mwFreebase	303.164
chemicalCompound:alogp	2.434
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	100.43
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	12.542
chemicalCompound:acdLogP	2.767
chemicalCompound:acdLogD	2.767
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	303.164
chemicalCompound:chemblId	CHEMBL1973142
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1394433
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:9507425, activity:9519332, activity:9519935, activity:9520160, activity:9520432, activity:9520653, activity:9523680, activity:9524017, activity:9525011, activity:9532528, activity:9532747, activity:9532864, activity:9533231, activity:9535928, activity:9536187, activity:9536440, activity:9539825, activity:9544726, activity:9544989, activity:9545318, activity:9548204, activity:9549279, activity:9552470, activity:9552670, activity:9557230, activity:9557616, activity:9557759, activity:9560986, activity:9561347, activity:9565658, activity:9568728, activity:9570128, activity:9570249, activity:9572099, activity:9574726, activity:9575098, activity:9575454, activity:9576115, activity:9576458, activity:9577577, activity:9578122, activity:9578315, activity:9579551, activity:9581276, activity:9582652, activity:9583056, activity:9583596, activity:9583884, activity:9584472, activity:9586585, activity:9589052, activity:9589184, activity:9589946, activity:9591942, activity:9592252, activity:9593344, activity:9593445, activity:9594098, activity:9594374, activity:9594695, activity:9595168, activity:9596286, activity:9597613, activity:9598758, activity:9599307, activity:9600485, activity:9601197