76766

Source:http://linkedlifedata.com/resource/chembl/compound/76766

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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:76766_Cloxacillin_FDA_ALTERNATIVE_NAME, synonym:76766_Cloxapen_OTHER, synonym:76766_Tegopen_OTHER
chemicalCompound:standardIn...	InChI=1S/C19H18ClN3O5S/c1-8-11(12(22-28-8)9-6-4-5-7-10(9)20)15(24)21-13-16(25)23-14(18(26)27)19(2,3)29-17(13)23/h4-7,13-14,17H,1-3H3,(H,21,24)(H,26,27)/t13-,14+,17-/m1/s1
chemicalCompound:standardIn...	LQOLIRLGBULYKD-JKIFEVAISA-N
chemicalCompound:canonicalS...	Cc1onc(c2ccccc2Cl)c1C(=O)N[C@H]3[C@H]4SC(C)(C)[C@@H](N4C3=O)C(=O)O
chemicalCompound:molecularF...	C19H18ClN3O5S
chemicalCompound:moleculeId	76766
chemicalCompound:mwFreebase	435.881
chemicalCompound:alogp	2.3
chemicalCompound:hba	6
chemicalCompound:hbd	2
chemicalCompound:psa	138.04
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	2.44
chemicalCompound:acdLogP	2.826
chemicalCompound:acdLogD	-0.903
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	435.881
chemicalCompound:chemblId	CHEMBL891
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:176766
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	CLOXACILLIN
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:49566
chemicalCompound:activity	activity:656234, activity:1079214, activity:1153428, activity:1490317, activity:1829640, activity:1829642, activity:1829644, activity:1829646, activity:1829648, activity:1829650, activity:1829652, activity:1829654, activity:1829656, activity:1829658, activity:1829660, activity:1829662, activity:1829664, activity:1829856, activity:1829858, activity:1829860, activity:1829924, activity:1829926, activity:1829928, activity:1829930, activity:1829932, activity:1829934, activity:1829936, activity:1829938, activity:1830288, activity:1830291, activity:1830294, activity:1830297, activity:1830300, activity:1830303, activity:1830306, activity:1830309, activity:1830312, activity:1830315, activity:1830318, activity:1830321, activity:1830324, activity:1830716, activity:1830720, activity:1830725, activity:1830732, activity:1830737, activity:1830742, activity:1830747, activity:1830752, activity:1830757, activity:1830762, activity:2060000, activity:2124057, activity:2124058, activity:2124063, activity:2124064, activity:2124065, activity:2124066, activity:2124067, activity:2124071, activity:2124072, activity:2129071