170395

Source:http://linkedlifedata.com/resource/chembl/compound/170395

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:229058
chemicalCompound:synonym	synonym:170395_Ditropan xl_TRADE_NAME, synonym:170395_Ditropan_TRADE_NAME, synonym:170395_Gelnique_TRADE_NAME, synonym:170395_MJ-4309-1_RESEARCH_CODE, synonym:170395_Oxybutynin Chloride_USAN, synonym:170395_Oxybutynin Chloride_USP, synonym:170395_Oxybutynin Hydrochloride_JAN, synonym:170395_Oxybutynin chloride_FDA_ALTERNATIVE_NAME, synonym:170395_Oxybutynin chloride_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C22H31NO3.ClH/c1-3-23(4-2)17-11-12-18-26-21(24)22(25,19-13-7-5-8-14-19)20-15-9-6-10-16-20;/h5,7-8,13-14,20,25H,3-4,6,9-10,15-18H2,1-2H3;1H
chemicalCompound:standardIn...	SWIJYDAEGSIQPZ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.CCN(CC)CC#CCOC(=O)C(O)(C1CCCCC1)c2ccccc2
chemicalCompound:molecularF...	C22H32ClNO3
chemicalCompound:moleculeId	170395
chemicalCompound:mwFreebase	357.486
chemicalCompound:alogp	4.646
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	49.77
chemicalCompound:rtb	10
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	11.946
chemicalCompound:acdLogP	5.049
chemicalCompound:acdLogD	4.154
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	393.947
chemicalCompound:acdMostBpk...	8.239
chemicalCompound:chemblId	CHEMBL1133
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:270395
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	Yes
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	OXYBUTYNIN CHLORIDE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:7857
chemicalCompound:activity	activity:733984, activity:733985, activity:733986, activity:1282198, activity:1282199, activity:1282200, activity:1282201, activity:1282202, activity:3473188, activity:3481330, activity:3481379, activity:3481540, activity:3481594, activity:3482310, activity:3482337, activity:3482589, activity:3634104, activity:3693219, activity:3695218, activity:3988127, activity:4278573, activity:4358383, activity:4535881, activity:4538237, activity:4552217, activity:4828270, activity:4920759, activity:4966416, activity:5316067, activity:5316714, activity:5703577, activity:5875764, activity:6586016, activity:6954933, activity:6979800, activity:7012538, activity:7184698, activity:7341396, activity:7444345, activity:7469833, activity:7526773, activity:7541040