Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:parent
chemicalCompound:standardIn...
InChI=1S/C16H15N.C4H4O4/c1-16-13-8-4-2-6-11(13)10-15(17-16)12-7-3-5-9-14(12)16;5-3(6)1-2-4(7)8/h2-9,15,17H,10H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
chemicalCompound:standardIn...
QLTXKCWMEZIHBJ-WLHGVMLRSA-N
chemicalCompound:canonicalS...
CC12NC(Cc3ccccc13)c4ccccc24.OC(=O)\C=C\C(=O)O
chemicalCompound:molecularF...
C20H19NO4
chemicalCompound:moleculeId
983366
chemicalCompound:mwFreebase
221.297
chemicalCompound:alogp
3.041
chemicalCompound:hba
1
chemicalCompound:hbd
1
chemicalCompound:psa
12.03
chemicalCompound:rtb
0
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdLogP
3.004
chemicalCompound:acdLogD
2.341
chemicalCompound:molecularS...
chemicalCompound:fullMwt
337.369
chemicalCompound:acdMostBpk...
7.958
chemicalCompound:chemblId
CHEMBL1559482
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