327491

Source:http://linkedlifedata.com/resource/chembl/compound/327491

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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/C23H28FN5O6/c1-14-12-27(9-8-19(14)26(3)21-6-7-22(35-21)29(32)33)20-5-4-16(10-18(20)24)28-13-17(34-23(28)31)11-25-15(2)30/h4-7,10,14,17,19H,8-9,11-13H2,1-3H3,(H,25,30)/t14?,17-,19?/m0/s1
chemicalCompound:standardIn...	KURFHWFPYZJMNJ-KGYZHSKHSA-N
chemicalCompound:canonicalS...	CC1CN(CCC1N(C)c2oc(cc2)[N+](=O)[O-])c3ccc(cc3F)N4C[C@H](CNC(=O)C)OC4=O
chemicalCompound:molecularF...	C23 H28 F N5 O6
chemicalCompound:moleculeId	327491
chemicalCompound:mwFreebase	489.497
chemicalCompound:alogp	2.685
chemicalCompound:hba	7
chemicalCompound:hbd	1
chemicalCompound:psa	124.08
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	3.063
chemicalCompound:acdLogD	3.063
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	489.497
chemicalCompound:acdMostBpk...	3.548
chemicalCompound:chemblId	CHEMBL364708
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:427491
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:1603949, activity:1603950, activity:1603951, activity:1603952, activity:1603953, activity:1603954