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706089
Source:
http://linkedlifedata.com/resource/chembl/compound/706089
Search
Subject
Predicate
Object
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(
48
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:706089
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:706089
chemicalCompound:parent
chemicalCompound:72191
lld:chembl
chemicalCompound:706089
chemicalCompound:standardIn...
InChI=1S/C14H23N5O.ClH/c1-3-4-5-6-7-11(10(2)20)19-9-18-12-13(15)16-8-17-14(12)19;/h8-11,20H,3-7H2,1-2H3,(H2,15,16,17);1H/t10-,11+;/m1./s1
lld:chembl
chemicalCompound:706089
chemicalCompound:standardIn...
VVDXNJRUNJMYOZ-DHXVBOOMSA-N
lld:chembl
chemicalCompound:706089
chemicalCompound:canonicalS...
Cl.CCCCCC[C@@H]([C@@H](C)O)n1cnc2c(N)ncnc12
lld:chembl
chemicalCompound:706089
chemicalCompound:molecularF...
C14H24ClN5O
lld:chembl
chemicalCompound:706089
chemicalCompound:moleculeId
706089
lld:chembl
chemicalCompound:706089
chemicalCompound:mwFreebase
277.365
lld:chembl
chemicalCompound:706089
chemicalCompound:alogp
2.328
lld:chembl
chemicalCompound:706089
chemicalCompound:hba
5
lld:chembl
chemicalCompound:706089
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:706089
chemicalCompound:psa
89.85
lld:chembl
chemicalCompound:706089
chemicalCompound:rtb
7
lld:chembl
chemicalCompound:706089
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:706089
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:706089
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:706089
chemicalCompound:acdLogP
2.613
lld:chembl
chemicalCompound:706089
chemicalCompound:acdLogD
2.612
lld:chembl
chemicalCompound:706089
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:706089
chemicalCompound:fullMwt
313.826
lld:chembl
chemicalCompound:706089
chemicalCompound:acdMostBpk...
4.329
lld:chembl
chemicalCompound:706089
chemicalCompound:chemblId
CHEMBL1257094
lld:chembl
chemicalCompound:706089
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:706089
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:706089
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:706089
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:706089
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:706089
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:706089
chemicalCompound:oral
No
lld:chembl
chemicalCompound:706089
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:706089
chemicalCompound:topical
No
lld:chembl
chemicalCompound:706089
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:706089
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:706089
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:706089
chemicalCompound:activity
activity:3649407
lld:chembl
chemicalCompound:706089
chemicalCompound:activity
activity:3695181
lld:chembl
chemicalCompound:706089
chemicalCompound:activity
activity:3988071
lld:chembl
chemicalCompound:706089
chemicalCompound:activity
activity:4084718
lld:chembl
chemicalCompound:706089
chemicalCompound:activity
activity:4745909
lld:chembl
chemicalCompound:706089
chemicalCompound:activity
activity:4921886
lld:chembl
chemicalCompound:706089
chemicalCompound:activity
activity:5855585
lld:chembl
chemicalCompound:706089
chemicalCompound:activity
activity:5874980
lld:chembl
chemicalCompound:706089
chemicalCompound:activity
activity:6647468
lld:chembl
chemicalCompound:706089
chemicalCompound:activity
activity:6773790
lld:chembl
chemicalCompound:706089
chemicalCompound:activity
activity:7454722
lld:chembl
chemicalCompound:706089
chemicalCompound:activity
activity:7510336
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:706089
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:706089
lld:chembl