674916

Source:http://linkedlifedata.com/resource/chembl/compound/674916

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:parent	chemicalCompound:453719
chemicalCompound:synonym	synonym:674916_Bacampicillin Hydrochloride_JAN, synonym:674916_Bacampicillin Hydrochloride_USAN, synonym:674916_Bacampicillin_BAN, synonym:674916_Bacampicillin_INN
chemicalCompound:standardIn...	InChI=1S/C21H27N3O7S.ClH/c1-5-29-20(28)31-11(2)30-19(27)15-21(3,4)32-18-14(17(26)24(15)18)23-16(25)13(22)12-9-7-6-8-10-12;/h6-11,13-15,18H,5,22H2,1-4H3,(H,23,25);1H/t11?,13-,14-,15+,18-;/m1./s1
chemicalCompound:standardIn...	IWVTXAGTHUECPN-ANBBSHPLSA-N
chemicalCompound:canonicalS...	Cl.CCOC(=O)OC(C)OC(=O)[C@@H]1N2[C@H](SC1(C)C)[C@H](NC(=O)[C@H](N)c3ccccc3)C2=O
chemicalCompound:molecularF...	C21H28ClN3O7S
chemicalCompound:moleculeId	674916
chemicalCompound:mwFreebase	465.52
chemicalCompound:alogp	1.399
chemicalCompound:hba	9
chemicalCompound:hbd	2
chemicalCompound:psa	162.55
chemicalCompound:rtb	10
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	12.163
chemicalCompound:acdLogP	3.521
chemicalCompound:acdLogD	3.442
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	501.981
chemicalCompound:acdMostBpk...	6.809
chemicalCompound:chemblId	CHEMBL1200965
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:774916
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	Yes
chemicalCompound:proDrug	No
chemicalCompound:prefName	BACAMPICILLIN HYDROCHLORIDE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:2969