88739

Source:http://linkedlifedata.com/resource/chembl/compound/88739

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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:88739_Erlosamide_OTHER, synonym:88739_Lacosamide_INN, synonym:88739_Lacosamide_USAN, synonym:88739_Vimpat_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C13H18N2O3/c1-10(16)15-12(9-18-2)13(17)14-8-11-6-4-3-5-7-11/h3-7,12H,8-9H2,1-2H3,(H,14,17)(H,15,16)/t12-/m1/s1
chemicalCompound:standardIn...	VPPJLAIAVCUEMN-GFCCVEGCSA-N
chemicalCompound:canonicalS...	COC[C@@H](NC(=O)C)C(=O)NCc1ccccc1
chemicalCompound:molecularF...	C13H18N2O3
chemicalCompound:moleculeId	88739
chemicalCompound:mwFreebase	250.294
chemicalCompound:alogp	0.021
chemicalCompound:hba	3
chemicalCompound:hbd	2
chemicalCompound:psa	67.43
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	0.728
chemicalCompound:acdLogD	0.728
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	250.294
chemicalCompound:chemblId	CHEMBL58323
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:188739
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	LACOSAMIDE
chemicalCompound:firstAppro...	2008
chemicalCompound:activity	activity:103705, activity:103706, activity:103707, activity:103708, activity:103709, activity:103710, activity:495542, activity:495543, activity:495544, activity:495545, activity:495546, activity:495547, activity:2486477, activity:2486478, activity:2486479, activity:2949513, activity:2949514, activity:2949515, activity:2949516, activity:2949517, activity:2949518, activity:2949519, activity:2949520, activity:2949521, activity:2949522, activity:2949523, activity:2949524, activity:2949525, activity:2984318, activity:2984319, activity:2984320, activity:2984321, activity:2985094, activity:2985137, activity:2985193, activity:2985210, activity:2985238, activity:2985246, activity:2985249, activity:2985272, activity:3256251, activity:3256271, activity:3256291, activity:3256311, activity:3256321, activity:3256340, activity:3256349, activity:3256355, activity:3256362, activity:3256376, activity:3256395, activity:3256421, activity:3256435, activity:3287925, activity:3287926, activity:3287927, activity:3287928, activity:3289070, activity:3289084, activity:3289091, activity:3401412, activity:3401444