32990

Source:http://linkedlifedata.com/resource/chembl/compound/32990

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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/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)
chemicalCompound:standardIn...	COLNVLDHVKWLRT-UHFFFAOYSA-N
chemicalCompound:canonicalS...	NC(Cc1ccccc1)C(=O)O
chemicalCompound:molecularF...	C9 H11 N O2
chemicalCompound:moleculeId	32990
chemicalCompound:mwFreebase	165.189
chemicalCompound:alogp	-1.605
chemicalCompound:hba	3
chemicalCompound:hbd	2
chemicalCompound:psa	63.32
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	2.21
chemicalCompound:acdLogP	0.235
chemicalCompound:acdLogD	-2.271
chemicalCompound:molecularS...	molecularSpecies:ZWITTERION
chemicalCompound:fullMwt	165.189
chemicalCompound:acdMostBpk...	9.2
chemicalCompound:chemblId	CHEMBL25080
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:132990
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	PHENYLALANINE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:28044
chemicalCompound:activity	activity:48840, activity:48841, activity:48842, activity:48843, activity:48844, activity:48845, activity:209435, activity:255508, activity:255509, activity:255510, activity:255511, activity:255512, activity:255513, activity:255514, activity:509671, activity:509672, activity:509673, activity:509674, activity:523916, activity:523917, activity:1157260, activity:1157261, activity:1157262, activity:1157263, activity:8291590, activity:8293362, activity:8334485, activity:8371334, activity:8408462, activity:8466056, activity:8503953, activity:8521755, activity:8555242, activity:8595967, activity:8598416, activity:8694750, activity:8787786, activity:8789862, activity:8813359, activity:8815744, activity:8934228, activity:8936750, activity:8979593, activity:8999725, activity:9024346, activity:9138792, activity:9196731, activity:9221804, activity:9234270, activity:9318722, activity:9329274, activity:9372698, activity:9383649, activity:9463041, activity:9529649, activity:9564539, activity:9697776, activity:9758079, activity:9802323, activity:9829151, activity:9900142, activity:9933991, activity:9967490, activity:9984764