28768

Source:http://linkedlifedata.com/resource/chembl/compound/28768

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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:60401
chemicalCompound:synonym	synonym:28768_Aredia_TRADE_NAME, synonym:28768_CGP-23339AE_RESEARCH_CODE, synonym:28768_Pamidronate Disodium_JAN, synonym:28768_Pamidronate Disodium_USAN, synonym:28768_Pamidronate disodium_FDA_ALTERNATIVE_NAME, synonym:28768_Pamidronate disodium_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C3H11NO7P2.2Na/c4-2-1-3(5,12(6,7)8)13(9,10)11;;/h5H,1-2,4H2,(H2,6,7,8)(H2,9,10,11);;/q;2*+1/p-2
chemicalCompound:standardIn...	CEYUIFJWVHOCPP-UHFFFAOYSA-L
chemicalCompound:canonicalS...	[Na+].[Na+].NCCC(O)(P(=O)(O)[O-])P(=O)(O)[O-]
chemicalCompound:molecularF...	C3 H9 N O7 P2 . 2 Na
chemicalCompound:moleculeId	28768
chemicalCompound:mwFreebase	235.069
chemicalCompound:alogp	-2.068
chemicalCompound:hba	8
chemicalCompound:hbd	6
chemicalCompound:psa	180.92
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	1.439
chemicalCompound:acdLogP	-0.894
chemicalCompound:acdLogD	-5.357
chemicalCompound:molecularS...	molecularSpecies:ZWITTERION
chemicalCompound:fullMwt	279.033
chemicalCompound:acdMostBpk...	8.927
chemicalCompound:chemblId	CHEMBL676
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:128768
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	PAMIDRONATE DISODIUM
chemicalCompound:firstAppro...	1991
chemicalCompound:activity	activity:1252683, activity:1252684, activity:1252685, activity:1252686