83772

Source:http://linkedlifedata.com/resource/chembl/compound/83772

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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:83772_Actonel_OTHER, synonym:83772_NE-58095_RESEARCH_CODE, synonym:83772_Risedronate_FDA_ALTERNATIVE_NAME, synonym:83772_Risedronic Acid_INN
chemicalCompound:standardIn...	InChI=1S/C7H11NO7P2/c9-7(16(10,11)12,17(13,14)15)4-6-2-1-3-8-5-6/h1-3,5,9H,4H2,(H2,10,11,12)(H2,13,14,15)
chemicalCompound:standardIn...	IIDJRNMFWXDHID-UHFFFAOYSA-N
chemicalCompound:canonicalS...	OC(Cc1cccnc1)(P(=O)(O)O)P(=O)(O)O
chemicalCompound:molecularF...	C7H11NO7P2
chemicalCompound:moleculeId	83772
chemicalCompound:mwFreebase	283.112
chemicalCompound:alogp	-0.263
chemicalCompound:hba	8
chemicalCompound:hbd	5
chemicalCompound:psa	167.8
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	1.41
chemicalCompound:acdLogP	0.548
chemicalCompound:acdLogD	-4.819
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	283.112
chemicalCompound:acdMostBpk...	5.073
chemicalCompound:chemblId	CHEMBL923
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:183772
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	RISEDRONIC ACID
chemicalCompound:firstAppro...	1998
chemicalCompound:activity	activity:509165, activity:509166, activity:509167, activity:509168, activity:509169, activity:509170, activity:509171, activity:509172, activity:509173, activity:509174, activity:509175, activity:718767, activity:718768, activity:718769, activity:718770, activity:772546, activity:772547, activity:772548, activity:772549, activity:772550, activity:772551, activity:772552, activity:781846, activity:781847, activity:781848, activity:781849, activity:781850, activity:781851, activity:781852, activity:871206, activity:871207, activity:903947, activity:903948, activity:1084768, activity:1084769, activity:1084770, activity:1299690, activity:1504226, activity:1504227, activity:1504228, activity:1505951, activity:1505952, activity:1505953, activity:1505954, activity:1609558, activity:1609559, activity:1609560, activity:1668097, activity:1668132, activity:1668133, activity:1668134, activity:1668135, activity:1668136, activity:1668137, activity:1765378, activity:1765444, activity:1765583, activity:1771575, activity:1804766, activity:2004196