24991

Source:http://linkedlifedata.com/resource/chembl/compound/24991

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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:24991_Cefalotin_INN, synonym:24991_Cephalothin_FDA_ALTERNATIVE_NAME, synonym:24991_Cephalothin_USAN, synonym:24991_Keflin_TRADE_NAME, synonym:24991_Seffin_OTHER
chemicalCompound:standardIn...	InChI=1S/C16H16N2O6S2/c1-8(19)24-6-9-7-26-15-12(14(21)18(15)13(9)16(22)23)17-11(20)5-10-3-2-4-25-10/h2-4,12,15H,5-7H2,1H3,(H,17,20)(H,22,23)/t12-,15-/m1/s1
chemicalCompound:standardIn...	XIURVHNZVLADCM-IUODEOHRSA-N
chemicalCompound:canonicalS...	CC(=O)OCC1=C(N2[C@H](SC1)[C@H](NC(=O)Cc3cccs3)C2=O)C(=O)O
chemicalCompound:molecularF...	C16H16N2O6S2
chemicalCompound:moleculeId	24991
chemicalCompound:mwFreebase	396.438
chemicalCompound:alogp	0.407
chemicalCompound:hba	7
chemicalCompound:hbd	2
chemicalCompound:psa	166.55
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	2.677
chemicalCompound:acdLogP	0.089
chemicalCompound:acdLogD	-3.617
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	396.438
chemicalCompound:chemblId	CHEMBL617
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:124991
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	Yes
chemicalCompound:proDrug	No
chemicalCompound:prefName	CEPHALOTHIN
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:124991
chemicalCompound:activity	activity:102161, activity:432786, activity:432787, activity:432788, activity:432789, activity:432790, activity:432791, activity:432792, activity:432793, activity:432794, activity:432795, activity:432796, activity:572829, activity:572830, activity:792611, activity:792612, activity:792613, activity:792614, activity:792615, activity:792616, activity:792617, activity:792618, activity:792619, activity:792620, activity:792621, activity:792622, activity:1078353, activity:1078354, activity:1078355, activity:1078356, activity:1078357, activity:1078358, activity:1078359, activity:1078360, activity:1078361, activity:1078362, activity:1078363, activity:1078364, activity:1078365, activity:1078366, activity:1078367, activity:1078368, activity:1078369, activity:1089745, activity:1089746, activity:1089747, activity:1089748, activity:1089749, activity:1089750, activity:1089751, activity:1089752, activity:1089753, activity:1133110, activity:1133111, activity:1406278, activity:1406279, activity:1448978, activity:1448979, activity:1448980, activity:1448981