139311

Source:http://linkedlifedata.com/resource/chembl/compound/139311

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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:139311_Lofepramine_INN
chemicalCompound:standardIn...	InChI=1S/C26H27ClN2O/c1-28(19-26(30)22-13-15-23(27)16-14-22)17-6-18-29-24-9-4-2-7-20(24)11-12-21-8-3-5-10-25(21)29/h2-5,7-10,13-16H,6,11-12,17-19H2,1H3
chemicalCompound:standardIn...	SAPNXPWPAUFAJU-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CN(CCCN1c2ccccc2CCc3ccccc13)CC(=O)c4ccc(Cl)cc4
chemicalCompound:molecularF...	C26 H27 Cl N2 O
chemicalCompound:moleculeId	139311
chemicalCompound:mwFreebase	418.958
chemicalCompound:alogp	6.308
chemicalCompound:hba	3
chemicalCompound:hbd	0
chemicalCompound:psa	23.55
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	6.169
chemicalCompound:acdLogD	6.116
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	418.958
chemicalCompound:acdMostBpk...	6.516
chemicalCompound:chemblId	CHEMBL87708
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:239311
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	LOFEPRAMINE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:47782
chemicalCompound:activity	activity:867352, activity:867353, activity:867354, activity:867355, activity:2062695, activity:3391860, activity:3391861, activity:3391862, activity:3391863, activity:3391864, activity:3391865, activity:3391866, activity:3391867, activity:3391868, activity:3391869, activity:3391870, activity:3391871, activity:3391872, activity:3391873, activity:3391874, activity:3391875, activity:3936754, activity:4359521, activity:4386461, activity:4801518, activity:5317527, activity:5318478, activity:5319429, activity:5758312, activity:6431135, activity:6442520, activity:6689137, activity:7553666, activity:7561592, activity:7564097, activity:9342691, activity:10298014