406787

Source:http://linkedlifedata.com/resource/chembl/compound/406787

Download in:

Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:406787_Albendazole_BAN, synonym:406787_Albendazole_FDA_ALTERNATIVE_NAME, synonym:406787_Albendazole_INN, synonym:406787_Albendazole_JAN, synonym:406787_Albendazole_USAN, synonym:406787_Albendazole_USP, synonym:406787_Albenza_TRADE_NAME, synonym:406787_Eskazole_TRADE_NAME, synonym:406787_SK&F-62979_RESEARCH_CODE, synonym:406787_Valbazen_TRADE_NAME, synonym:406787_Zental_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C12H15N3O2S/c1-3-6-18-8-4-5-9-10(7-8)14-11(13-9)15-12(16)17-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)
chemicalCompound:standardIn...	HXHWSAZORRCQMX-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCSc1ccc2nc(NC(=O)OC)[nH]c2c1
chemicalCompound:molecularF...	C12H15N3O2S
chemicalCompound:moleculeId	406787
chemicalCompound:mwFreebase	265.331
chemicalCompound:alogp	3.065
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	92.31
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	10.717
chemicalCompound:acdLogP	3.001
chemicalCompound:acdLogD	2.992
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	265.331
chemicalCompound:acdMostBpk...	5.369
chemicalCompound:chemblId	CHEMBL1483
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:506787
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	ALBENDAZOLE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:16664
chemicalCompound:firstAppro...	1996
chemicalCompound:activity	activity:172891, activity:172892, activity:172893, activity:172894, activity:172895, activity:172896, activity:172897, activity:172898, activity:172899, activity:172900, activity:172901, activity:172902, activity:172903, activity:172904, activity:172905, activity:172906, activity:172907, activity:172908, activity:172909, activity:172910, activity:172911, activity:172912, activity:172913, activity:172914, activity:177911, activity:177912, activity:177913, activity:177914, activity:177915, activity:177916, activity:177917, activity:177918, activity:177919, activity:177920, activity:639106, activity:890315, activity:1131031, activity:1131032, activity:1131033, activity:1502858, activity:1502859, activity:1502860, activity:1669126, activity:1670282, activity:1670322, activity:1688897, activity:1996331, activity:2038566, activity:2038567, activity:2038568, activity:2038569, activity:2038570