203510

Source:http://linkedlifedata.com/resource/chembl/compound/203510

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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/C13H17N2O9P/c1-2-7-4-15(13(20)14-12(7)19)10-3-8(16)9(24-10)5-23-25(21,22)6-11(17)18/h2,4,8-10,16H,1,3,5-6H2,(H,17,18)(H,21,22)(H,14,19,20)
chemicalCompound:standardIn...	SBGFTEXUCNYCBX-UHFFFAOYSA-N
chemicalCompound:canonicalS...	OC1CC(OC1COP(=O)(O)CC(=O)O)N2C=C(C=C)C(=O)NC2=O
chemicalCompound:molecularF...	C13 H17 N2 O9 P
chemicalCompound:moleculeId	203510
chemicalCompound:mwFreebase	376.256
chemicalCompound:alogp	-1.877
chemicalCompound:hba	9
chemicalCompound:hbd	4
chemicalCompound:psa	172.5
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	1.754
chemicalCompound:acdLogP	-1.62
chemicalCompound:acdLogD	-6.361
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	376.256
chemicalCompound:chemblId	CHEMBL124823
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:303510
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:615853, activity:615854