699395

Source:http://linkedlifedata.com/resource/chembl/compound/699395

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:699395_Tramadol_BAN, synonym:699395_Tramadol_FDA_ALTERNATIVE_NAME, synonym:699395_Tramadol_INN, synonym:699395_Ultracet_OTHER, synonym:699395_Ultram-ER_TRADE_NAME, synonym:699395_Ultram_OTHER, synonym:699395_Ultram_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C16H25NO2/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3
chemicalCompound:standardIn...	TVYLLZQTGLZFBW-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COc1cccc(c1)C2(O)CCCCC2CN(C)C
chemicalCompound:molecularF...	C16H25NO2
chemicalCompound:moleculeId	699395
chemicalCompound:mwFreebase	263.375
chemicalCompound:alogp	2.7
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	32.7
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.316
chemicalCompound:acdLogD	0.291
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	263.375
chemicalCompound:acdMostBpk...	9.606
chemicalCompound:chemblId	CHEMBL1237044
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:799395
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	TRAMADOL
chemicalCompound:activity	activity:252397, activity:873582, activity:873583, activity:873584, activity:873585, activity:1504408, activity:1679564, activity:1679565, activity:1679566, activity:1679567, activity:1679569, activity:1679570, activity:2060032, activity:2062713, activity:2062773, activity:2062789, activity:2103938, activity:2103939, activity:2103940, activity:2104013, activity:2104014, activity:2104015, activity:2104016, activity:2104049, activity:2104056, activity:2104057, activity:2263707, activity:2263708, activity:2263709, activity:2264990, activity:2264991, activity:2357328, activity:2364146, activity:2364327, activity:2672745, activity:2672746, activity:2978262, activity:2979661, activity:2979835, activity:2979859, activity:2993410, activity:2993490, activity:2994650, activity:2994864, activity:2996377, activity:3216114, activity:3216205, activity:3217432, activity:3265143, activity:3336506, activity:3336507, activity:3596868, activity:5080698, activity:5081858, activity:5082466, activity:5082545, activity:5082636, activity:5317918, activity:5318869