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1088335
Source:
http://linkedlifedata.com/resource/chembl/compound/1088335
Search
Subject
Predicate
Object
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(
36
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:1088335
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:1088335
chemicalCompound:parent
chemicalCompound:1219
lld:chembl
chemicalCompound:1088335
chemicalCompound:standardIn...
InChI=1S/C27H38N2O4.ClH.H2O/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6;;/h9-12,17-18,20H,8,13-16H2,1-7H3;1H;1H2
lld:chembl
chemicalCompound:1088335
chemicalCompound:standardIn...
ICKXRKHJKXMFLR-UHFFFAOYSA-N
lld:chembl
chemicalCompound:1088335
chemicalCompound:canonicalS...
O.Cl.COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC
lld:chembl
chemicalCompound:1088335
chemicalCompound:molecularF...
C27H41ClN2O5
lld:chembl
chemicalCompound:1088335
chemicalCompound:moleculeId
1088335
lld:chembl
chemicalCompound:1088335
chemicalCompound:mwFreebase
454.602
lld:chembl
chemicalCompound:1088335
chemicalCompound:alogp
5.534
lld:chembl
chemicalCompound:1088335
chemicalCompound:hba
6
lld:chembl
chemicalCompound:1088335
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:1088335
chemicalCompound:psa
63.95
lld:chembl
chemicalCompound:1088335
chemicalCompound:rtb
13
lld:chembl
chemicalCompound:1088335
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:1088335
chemicalCompound:numRo5viol...
1
lld:chembl
chemicalCompound:1088335
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:1088335
chemicalCompound:acdLogP
4.024
lld:chembl
chemicalCompound:1088335
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:1088335
chemicalCompound:fullMwt
509.078
lld:chembl
chemicalCompound:1088335
chemicalCompound:acdMostBpk...
8.97
lld:chembl
chemicalCompound:1088335
chemicalCompound:chemblId
CHEMBL1707604
lld:chembl
chemicalCompound:1088335
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:1088335
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:1088335
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:1088335
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:1088335
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:1088335
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:1088335
chemicalCompound:oral
No
lld:chembl
chemicalCompound:1088335
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:1088335
chemicalCompound:topical
No
lld:chembl
chemicalCompound:1088335
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:1088335
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:1088335
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:1088335
chemicalCompound:activity
activity:5560156
lld:chembl
chemicalCompound:1088335
chemicalCompound:activity
activity:7532632
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:1088335
lld:chembl