996132

Source:http://linkedlifedata.com/resource/chembl/compound/996132

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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/C28H26FN3O4/c29-24-9-3-1-6-20(24)18-31-25-10-4-2-8-23(25)27(34)32(28(31)35)21-13-11-19(12-14-21)16-26(33)30-17-22-7-5-15-36-22/h1-4,6,8-14,22H,5,7,15-18H2,(H,30,33)
chemicalCompound:standardIn...	IRZFSMRPTZEUFT-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Fc1ccccc1CN2C(=O)N(C(=O)c3ccccc23)c4ccc(CC(=O)NCC5CCCO5)cc4
chemicalCompound:molecularF...	C28H26FN3O4
chemicalCompound:moleculeId	996132
chemicalCompound:mwFreebase	487.522
chemicalCompound:alogp	3.943
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	78.95
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.292
chemicalCompound:acdLogD	4.292
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	487.522
chemicalCompound:chemblId	CHEMBL1572248
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1096132
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:4428215, activity:5573276, activity:5870289, activity:6460842, activity:6562656, activity:7232777, activity:9824982, activity:9967581