Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:standardIn...
InChI=1S/C23H23ClN2O2S/c1-15(27)28-21-19-13-12-17(14-25(2)3)26(19)20-11-7-10-18(24)23(20)29-22(21)16-8-5-4-6-9-16/h4-13,21-22H,14H2,1-3H3/t21-,22-/m0/s1
chemicalCompound:standardIn...
JGXAGHYDVHPDLO-VXKWHMMOSA-N
chemicalCompound:canonicalS...
CN(C)Cc1ccc2[C@H](OC(=O)C)[C@@H](Sc3c(Cl)cccc3n12)c4ccccc4
chemicalCompound:molecularF...
C23 H23 Cl N2 O2 S
chemicalCompound:moleculeId
33006
chemicalCompound:mwFreebase
426.959
chemicalCompound:alogp
5.482
chemicalCompound:hba
4
chemicalCompound:hbd
0
chemicalCompound:psa
59.77
chemicalCompound:rtb
5
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
1
chemicalCompound:medChemFri...
Y
chemicalCompound:acdLogP
5.928
chemicalCompound:acdLogD
4.252
chemicalCompound:molecularS...
chemicalCompound:fullMwt
426.959
chemicalCompound:acdMostBpk...
9.083
chemicalCompound:chemblId
CHEMBL284195
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