508755

Source:http://linkedlifedata.com/resource/chembl/compound/508755

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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:508755_Cefobid_TRADE_NAME, synonym:508755_Cefoperazone_FDA_ALTERNATIVE_NAME
chemicalCompound:standardIn...	InChI=1S/C25H27N9O8S2/c1-3-32-8-9-33(21(39)20(32)38)24(42)27-15(12-4-6-14(35)7-5-12)18(36)26-16-19(37)34-17(23(40)41)13(10-43-22(16)34)11-44-25-28-29-30-31(25)2/h4-7,15-16,22,35H,3,8-11H2,1-2H3,(H,26,36)(H,27,42)(H,40,41)/t15-,16-,22-/m1/s1
chemicalCompound:standardIn...	GCFBRXLSHGKWDP-XCGNWRKASA-N
chemicalCompound:canonicalS...	CCN1CCN(C(=O)N[C@@H](C(=O)N[C@H]2[C@H]3SCC(=C(N3C2=O)C(=O)O)CSc4nnnn4C)c5ccc(O)cc5)C(=O)C1=O
chemicalCompound:molecularF...	C25H27N9O8S2
chemicalCompound:moleculeId	508755
chemicalCompound:mwFreebase	645.667
chemicalCompound:alogp	-0.792
chemicalCompound:hba	13
chemicalCompound:hbd	4
chemicalCompound:psa	270.85
chemicalCompound:rtb	9
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	2
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	2.621
chemicalCompound:acdLogP	-1.111
chemicalCompound:acdLogD	-4.824
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	645.667
chemicalCompound:acdMostBpk...	0.672
chemicalCompound:chemblId	CHEMBL507674
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:608755
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	CEFOPERAZONE
chemicalCompound:firstAppro...	1982
chemicalCompound:activity	activity:283061, activity:283062, activity:283063, activity:283064, activity:283065, activity:288672, activity:288673, activity:288674, activity:288675, activity:288676, activity:2126411, activity:2126426, activity:2126441, activity:2126456, activity:2126471, activity:2126486, activity:2126501, activity:2129076, activity:2129102, activity:2129128, activity:2129155, activity:2129185, activity:2129213, activity:2129248, activity:2301031, activity:2301032, activity:2306317, activity:2306325, activity:2306333, activity:2344540, activity:2344554, activity:2344557, activity:2344568, activity:3216058, activity:3216149, activity:3217376, activity:3475624, activity:3475645, activity:3475666, activity:3475687, activity:3476962, activity:3476963, activity:3476964, activity:3476965, activity:3476966, activity:3476967, activity:3493984, activity:3493996, activity:3494008, activity:3494030, activity:3494043, activity:3494938, activity:3494950, activity:3494962, activity:3494974, activity:3494986, activity:3494998, activity:3495010, activity:3495022, activity:3495034, activity:3495046, activity:3513780