1319143

Source:http://linkedlifedata.com/resource/chembl/compound/1319143

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:7725
chemicalCompound:standardIn...	InChI=1S/C23H16O11.Na/c24-11(9-31-14-3-1-5-16-20(14)12(25)7-18(33-16)22(27)28)10-32-15-4-2-6-17-21(15)13(26)8-19(34-17)23(29)30;/h1-8,11,24H,9-10H2,(H,27,28)(H,29,30);/q;+1
chemicalCompound:standardIn...	FOXZSJZEADRHAD-UHFFFAOYSA-N
chemicalCompound:canonicalS...	[Na+].OC(COc1cccc2OC(=CC(=O)c12)C(=O)O)COc3cccc4OC(=CC(=O)c34)C(=O)O
chemicalCompound:molecularF...	C23H16NaO11
chemicalCompound:moleculeId	1319143
chemicalCompound:mwFreebase	468.367
chemicalCompound:alogp	1.77
chemicalCompound:hba	11
chemicalCompound:hbd	3
chemicalCompound:psa	165.89
chemicalCompound:rtb	8
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	1.943
chemicalCompound:acdLogP	1.997
chemicalCompound:acdLogD	-2.753
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	491.356
chemicalCompound:chemblId	CHEMBL1997852
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1419143
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:8243354, activity:8250709, activity:8301969, activity:8367528, activity:8401256, activity:8456404, activity:8485253, activity:8527648, activity:8570306, activity:8639613, activity:8651080, activity:8658373, activity:8713587, activity:8755685, activity:8771755, activity:8860111, activity:8895612, activity:8902347, activity:8963411, activity:9000652, activity:9044313, activity:9063948, activity:9089455, activity:9122461, activity:9180480, activity:9277420, activity:9288712, activity:9352692, activity:9422237, activity:9424855, activity:9501273, activity:9503655, activity:9555452, activity:9675749, activity:9712991, activity:9776047, activity:9815363, activity:9863930, activity:9893014, activity:9926853, activity:9994622, activity:10023465, activity:10030024, activity:10060274, activity:10118302, activity:10160193, activity:10250931, activity:10270790, activity:10325172, activity:10373906, activity:10397432, activity:10437104, activity:10494999, activity:10513442, activity:10583673, activity:10665822, activity:10696930, activity:10742802, activity:10769788, activity:10794187