Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:standardIn...
InChI=1S/C18H14BrNO3/c1-23-17-9-12(14(19)10-16(17)22)6-8-13-7-5-11-3-2-4-15(21)18(11)20-13/h2-10,21-22H,1H3/b8-6+
chemicalCompound:standardIn...
YOCHPEADEQUVAH-SOFGYWHQSA-N
chemicalCompound:canonicalS...
COc1cc(\C=C\c2ccc3cccc(O)c3n2)c(Br)cc1O
chemicalCompound:molecularF...
C18H14BrNO3
chemicalCompound:moleculeId
977886
chemicalCompound:mwFreebase
372.213
chemicalCompound:alogp
4.679
chemicalCompound:hba
4
chemicalCompound:hbd
2
chemicalCompound:psa
62.58
chemicalCompound:rtb
3
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
8.585
chemicalCompound:acdLogP
4.478
chemicalCompound:acdLogD
3.958
chemicalCompound:molecularS...
chemicalCompound:fullMwt
372.213
chemicalCompound:acdMostBpk...
9.935
chemicalCompound:chemblId
CHEMBL1554002
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