16416

Source:http://linkedlifedata.com/resource/chembl/compound/16416

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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/C12H10O4/c1-12(8-5-3-2-4-6-8)10(13)7-9(16-12)11(14)15/h2-7H,1H3,(H,14,15)
chemicalCompound:standardIn...	DFDGRKNOFOJBAJ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC1(OC(=CC1=O)C(=O)O)c2ccccc2
chemicalCompound:molecularF...	C12H10O4
chemicalCompound:moleculeId	16416
chemicalCompound:mwFreebase	218.205
chemicalCompound:alogp	1.544
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	63.6
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	2.255
chemicalCompound:acdLogP	2.04
chemicalCompound:acdLogD	-1.693
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	218.205
chemicalCompound:chemblId	CHEMBL278488
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:116416
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	ACIFRAN
chemicalCompound:activity	activity:311027, activity:311028, activity:311029, activity:312407, activity:312408, activity:312409, activity:322338, activity:322339, activity:322340, activity:322341, activity:322342, activity:322343, activity:322344, activity:322345, activity:322346, activity:322347, activity:322348, activity:322349, activity:322350, activity:322351, activity:322352, activity:881747, activity:1824969, activity:1824977, activity:1825017, activity:1825019, activity:1825213, activity:1833208, activity:1833209, activity:2471787, activity:2471796, activity:2471797, activity:2471798, activity:2692233, activity:2692234