51

Source:http://linkedlifedata.com/resource/chembl/compound/51

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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:51_UCL-1530_RESEARCH_CODE
chemicalCompound:standardIn...	InChI=1S/C43H46N4/c1-2-4-6-12-28-45-41-26-30-47(43-16-10-8-14-39(41)43)33-37-23-19-35(20-24-37)31-34-17-21-36(22-18-34)32-46-29-25-40(44-27-11-5-3-1)38-13-7-9-15-42(38)46/h7-10,13-26,29-30H,1-6,11-12,27-28,31-33H2/p+2/b44-40+,45-41+
chemicalCompound:standardIn...	SXDHPHPRCINSFL-QEXFJYHKSA-P
chemicalCompound:canonicalS...	C1CCCCCNc2cc[n+](Cc3ccc(Cc4ccc(C[n+]5ccc(NCCCC1)c6ccccc56)cc4)cc3)c7ccccc27
chemicalCompound:molecularF...	C43 H48 N4
chemicalCompound:moleculeId	51
chemicalCompound:mwFreebase	620.868
chemicalCompound:alogp	11.395
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	31.82
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	2
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	5.415
chemicalCompound:acdLogD	5.415
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	620.868
chemicalCompound:chemblId	CHEMBL446445
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:100051
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	UCL-1530
chemicalCompound:activity	activity:282624, activity:282625, activity:496732, activity:496733, activity:1441289