Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:standardIn...
InChI=1S/C32H46N4O8/c1-19(2)23(29(39)33-5)35-31(41)27(43-17-21-13-9-7-10-14-21)25(37)26(38)28(44-18-22-15-11-8-12-16-22)32(42)36-24(20(3)4)30(40)34-6/h7-16,19-20,23-28,37-38H,17-18H2,1-6H3,(H,33,39)(H,34,40)(H,35,41)(H,36,42)/t23-,24-,25+,26+,27+,28+/m0/s1
chemicalCompound:standardIn...
QHMBKCCJSCSGHG-BQXGFVACSA-N
chemicalCompound:canonicalS...
CNC(=O)[C@@H](NC(=O)[C@H](OCc1ccccc1)[C@H](O)[C@@H](O)[C@@H](OCc2ccccc2)C(=O)N[C@@H](C(C)C)C(=O)NC)C(C)C
chemicalCompound:molecularF...
C32 H46 N4 O8
chemicalCompound:moleculeId
170680
chemicalCompound:mwFreebase
614.73
chemicalCompound:alogp
1.229
chemicalCompound:hba
8
chemicalCompound:hbd
6
chemicalCompound:psa
175.31
chemicalCompound:rtb
17
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
2
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
12.256
chemicalCompound:acdLogP
5.789
chemicalCompound:acdLogD
5.788
chemicalCompound:molecularS...
chemicalCompound:fullMwt
614.73
chemicalCompound:chemblId
CHEMBL105459
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