Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:parent
chemicalCompound:standardIn...
InChI=1S/C16H25NO.ClH/c1-3-10-17(11-4-2)14-8-9-15-13(12-14)6-5-7-16(15)18;/h5-7,14,18H,3-4,8-12H2,1-2H3;1H/t14-;/m0./s1
chemicalCompound:standardIn...
XWCUJMPFGVUNNH-UQKRIMTDSA-N
chemicalCompound:canonicalS...
Cl.CCCN(CCC)[C@H]1CCc2c(O)cccc2C1
chemicalCompound:molecularF...
C16H26ClNO
chemicalCompound:moleculeId
1152040
chemicalCompound:mwFreebase
247.376
chemicalCompound:alogp
4.287
chemicalCompound:hba
2
chemicalCompound:hbd
1
chemicalCompound:psa
23.47
chemicalCompound:rtb
5
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
10.543
chemicalCompound:acdLogP
3.55
chemicalCompound:acdLogD
1.68
chemicalCompound:molecularS...
chemicalCompound:fullMwt
283.837
chemicalCompound:acdMostBpk...
9.387
chemicalCompound:chemblId
CHEMBL1788376
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
chemicalCompound:chebi
chemicalCompound:moleculeTy...
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:activity