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Sources
150
Source:
http://linkedlifedata.com/resource/chembl/compound/150
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Subject
(
33
)
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Inference
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Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:standardIn...
InChI=1S/C32H42N2O10/c1-38-24-14-21(15-25(39-2)28(24)42-5)30(35)33-12-13-34(23(18-33)19-44-32(37)20-10-8-7-9-11-20)31(36)22-16-26(40-3)29(43-6)27(17-22)41-4/h14-17,20,23H,7-13,18-19H2,1-6H3
chemicalCompound:standardIn...
BLDZWCUVWBMDLL-UHFFFAOYSA-N
chemicalCompound:canonicalS...
COc1cc(cc(OC)c1OC)C(=O)N2CCN(C(COC(=O)C3CCCCC3)C2)C(=O)c4cc(OC)c(OC)c(OC)c4
chemicalCompound:molecularF...
C32 H42 N2 O10
chemicalCompound:moleculeId
150
chemicalCompound:mwFreebase
614.683
chemicalCompound:alogp
4.021
chemicalCompound:hba
10
chemicalCompound:hbd
0
chemicalCompound:psa
122.3
chemicalCompound:rtb
12
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
1
chemicalCompound:medChemFri...
Y
chemicalCompound:acdLogP
2.672
chemicalCompound:acdLogD
2.672
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
chemicalCompound:fullMwt
614.683
chemicalCompound:chemblId
CHEMBL268597
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:100150
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:48046