65798

Source:http://linkedlifedata.com/resource/chembl/compound/65798

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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:65798_Bioepiderm_TRADE_NAME, synonym:65798_Biotin 100_TRADE_NAME, synonym:65798_Biotin_FDA_ALTERNATIVE_NAME, synonym:65798_Biotin_INN, synonym:65798_Biotin_JAN, synonym:65798_Biotin_USAN, synonym:65798_Biotin_USP, synonym:65798_Vitamin H_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1
chemicalCompound:standardIn...	YBJHBAHKTGYVGT-ZKWXMUAHSA-N
chemicalCompound:canonicalS...	OC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12
chemicalCompound:molecularF...	C10H16N2O3S
chemicalCompound:moleculeId	65798
chemicalCompound:mwFreebase	244.311
chemicalCompound:alogp	0.67
chemicalCompound:hba	4
chemicalCompound:hbd	3
chemicalCompound:psa	103.72
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	4.739
chemicalCompound:acdLogP	0.861
chemicalCompound:acdLogD	-1.769
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	244.311
chemicalCompound:chemblId	CHEMBL857
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:165798
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	BIOTIN
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:15956
chemicalCompound:firstAppro...	1985
chemicalCompound:activity	activity:204644, activity:273930, activity:273931, activity:478889, activity:478890, activity:1462678, activity:2987941, activity:5103016, activity:5316321, activity:5316542, activity:5317139, activity:5318090, activity:5319041, activity:5405709, activity:5776646, activity:6261134, activity:6347844, activity:6434785, activity:6459133, activity:6997439, activity:7067291, activity:7551057, activity:7840117, activity:7840143, activity:10170478, activity:10216967