1159075

Source:http://linkedlifedata.com/resource/chembl/compound/1159075

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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/C25H31N3O3/c1-31-23-11-6-5-10-22(23)27-16-14-26(15-17-27)12-7-13-28-24(29)18-21(19-25(28)30)20-8-3-2-4-9-20/h2-6,8-11,21H,7,12-19H2,1H3
chemicalCompound:standardIn...	LVTVPXIZHDLZMO-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COc1ccccc1N2CCN(CCCN3C(=O)CC(CC3=O)c4ccccc4)CC2
chemicalCompound:molecularF...	C25H31N3O3
chemicalCompound:moleculeId	1159075
chemicalCompound:mwFreebase	421.532
chemicalCompound:alogp	2.967
chemicalCompound:hba	5
chemicalCompound:hbd	0
chemicalCompound:psa	53.09
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.103
chemicalCompound:acdLogD	2.823
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	421.532
chemicalCompound:acdMostBpk...	7.596
chemicalCompound:chemblId	CHEMBL1796030
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1259075
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:6264397, activity:6264398, activity:6264399