88797

Source:http://linkedlifedata.com/resource/chembl/compound/88797

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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:88797_Gleevec_OTHER, synonym:88797_Gleevec_TRADE_NAME, synonym:88797_Imatinib_FDA_ALTERNATIVE_NAME, synonym:88797_Imatinib_INN, synonym:88797_Imatinib_USAN, synonym:88797_STI-571_RESEARCH_CODE
chemicalCompound:standardIn...	InChI=1S/C29H31N7O/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34)
chemicalCompound:standardIn...	KTUFNOKKBVMGRW-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CN1CCN(Cc2ccc(cc2)C(=O)Nc3ccc(C)c(Nc4nccc(n4)c5cccnc5)c3)CC1
chemicalCompound:molecularF...	C29H31N7O
chemicalCompound:moleculeId	88797
chemicalCompound:mwFreebase	493.603
chemicalCompound:alogp	3.583
chemicalCompound:hba	7
chemicalCompound:hbd	2
chemicalCompound:psa	86.28
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	13.279
chemicalCompound:acdLogP	2.887
chemicalCompound:acdLogD	2.486
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	493.603
chemicalCompound:acdMostBpk...	7.553
chemicalCompound:chemblId	CHEMBL941
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:188797
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	IMATINIB
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:45783
chemicalCompound:firstAppro...	2001
chemicalCompound:activity	activity:388530, activity:388531, activity:394752, activity:581031, activity:884643, activity:884644, activity:884645, activity:884646, activity:909963, activity:909964, activity:909965, activity:909966, activity:909967, activity:909968, activity:909969, activity:909970, activity:909971, activity:1611776, activity:1611777, activity:1611778, activity:1611779, activity:1614495, activity:1614496, activity:1614497, activity:1614498, activity:1614499, activity:1651077, activity:1651088, activity:1651099, activity:1651110, activity:1651121, activity:1651132, activity:1651143, activity:1651154, activity:1651165, activity:1651176, activity:1651187, activity:1651198, activity:1651209, activity:1651220, activity:1651231, activity:1651242, activity:1651253, activity:1651264, activity:1651275, activity:1651286, activity:1651297, activity:1651308, activity:1651319, activity:1651330, activity:1651341, activity:1651352, activity:1651363, activity:1651374, activity:1651385, activity:1651396, activity:1651407