34909

Source:http://linkedlifedata.com/resource/chembl/compound/34909

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C26H28ClF3N4O5S/c1-4-5-6-22-32-24(27)21(14-23(35)39-3)34(22)15-17-8-10-18(11-9-17)31-25(36)19-13-16(2)7-12-20(19)33-40(37,38)26(28,29)30/h7-13,33H,4-6,14-15H2,1-3H3,(H,31,36)
chemicalCompound:standardIn...	ZYHZOLWXHNEBGU-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCc1nc(Cl)c(CC(=O)OC)n1Cc2ccc(NC(=O)c3cc(C)ccc3NS(=O)(=O)C(F)(F)F)cc2
chemicalCompound:molecularF...	C26 H28 Cl F3 N4 O5 S
chemicalCompound:moleculeId	34909
chemicalCompound:mwFreebase	601.038
chemicalCompound:alogp	6.72
chemicalCompound:hba	6
chemicalCompound:hbd	2
chemicalCompound:psa	127.77
chemicalCompound:rtb	13
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	2
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	3.891
chemicalCompound:acdLogP	5.768
chemicalCompound:acdLogD	3.778
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	601.038
chemicalCompound:acdMostBpk...	4.091
chemicalCompound:chemblId	CHEMBL286028
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:134909
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:646820, activity:646821