354883

Source:http://linkedlifedata.com/resource/chembl/compound/354883

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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:354883_BMS-740808_RESEARCH_CODE
chemicalCompound:standardIn...	InChI=1S/C31H27F3N6O3/c32-31(33,34)28-24-12-14-39(30(42)27(24)40(36-28)21-9-10-26-25(15-21)29(35)37-43-26)20-7-5-18(6-8-20)23-4-2-1-3-19(23)16-38-13-11-22(41)17-38/h1-10,15,22,41H,11-14,16-17H2,(H2,35,37)/t22-/m1/s1
chemicalCompound:standardIn...	DFRIQJHMGZBFOM-JOCHJYFZSA-N
chemicalCompound:canonicalS...	Nc1noc2ccc(cc12)n3nc(c4CCN(C(=O)c34)c5ccc(cc5)c6ccccc6CN7CC[C@@H](O)C7)C(F)(F)F
chemicalCompound:molecularF...	C31H27F3N6O3
chemicalCompound:moleculeId	354883
chemicalCompound:mwFreebase	588.58
chemicalCompound:alogp	5.192
chemicalCompound:hba	6
chemicalCompound:hbd	2
chemicalCompound:psa	113.65
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	2
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	6.066
chemicalCompound:acdLogD	4.843
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	588.58
chemicalCompound:acdMostBpk...	8.551
chemicalCompound:chemblId	CHEMBL378093
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:454883
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:40148
chemicalCompound:activity	activity:1754997, activity:1754998, activity:1754999, activity:1755000, activity:1755001, activity:1755002, activity:1755006, activity:1755007, activity:1755024, activity:1755032, activity:1755049, activity:1755064, activity:1755074, activity:1755082, activity:1755115, activity:1755117, activity:1755121, activity:1755184, activity:1809525, activity:1809546, activity:1809563, activity:1809568, activity:1809573, activity:1809578, activity:1809584, activity:1809612, activity:1993508, activity:1993553, activity:1993554, activity:1993556, activity:1993558, activity:1993560, activity:1993562, activity:1993565, activity:1993574, activity:2073458, activity:2073461, activity:2073511, activity:3514966, activity:3514967