674375

Source:http://linkedlifedata.com/resource/chembl/compound/674375

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:parent	chemicalCompound:46073
chemicalCompound:synonym	synonym:674375_Pentetate Zinc Trisodium_USAN, synonym:674375_Pentetate zinc trisodium_OTHER
chemicalCompound:standardIn...	InChI=1S/C14H23N3O10.3Na.Zn/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27;;;;/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27);;;;/q;3*+1;+2/p-5
chemicalCompound:standardIn...	HVASDHJNLYRZEA-UHFFFAOYSA-I
chemicalCompound:canonicalS...	[Na+].[Na+].[Na+].[Zn+2].[O-]C(=O)CN(CCN(CC(=O)[O-])CC(=O)[O-])CCN(CC(=O)[O-])CC(=O)[O-]
chemicalCompound:molecularF...	C14H18N3Na3O10Zn
chemicalCompound:moleculeId	674375
chemicalCompound:mwFreebase	393.346
chemicalCompound:alogp	-11.1
chemicalCompound:hba	13
chemicalCompound:hbd	5
chemicalCompound:psa	196.21
chemicalCompound:rtb	16
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	1.481
chemicalCompound:acdLogP	-1.361
chemicalCompound:acdLogD	-7.356
chemicalCompound:molecularS...	molecularSpecies:ZWITTERION
chemicalCompound:fullMwt	522.685
chemicalCompound:acdMostBpk...	11.239
chemicalCompound:chemblId	CHEMBL1200424
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:774375
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	Yes
chemicalCompound:topical	Yes
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	PENTETATE ZINC TRISODIUM
chemicalCompound:firstAppro...	2004