Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:standardIn...
InChI=1S/C43H72N4O8/c1-5-6-17-39(55-40(29-34-15-11-8-12-16-34)43(51)47-21-18-35(19-22-47)54-31-52-4)42(50)45-37(28-33-13-9-7-10-14-33)38(48)30-36(32(2)3)41(49)44-20-23-46-24-26-53-27-25-46/h8,11-12,15-16,32-33,35-40,48H,5-7,9-10,13-14,17-31H2,1-4H3,(H,44,49)(H,45,50)/t36-,37-,38-,39-,40-/m0/s1
chemicalCompound:standardIn...
HWFCKWSICMSWPT-HECCNADXSA-N
chemicalCompound:canonicalS...
CCCC[C@H](O[C@@H](Cc1ccccc1)C(=O)N2CCC(CC2)OCOC)C(=O)N[C@@H](CC3CCCCC3)[C@@H](O)C[C@@H](C(C)C)C(=O)NCCN4CCOCC4
chemicalCompound:molecularF...
C43 H72 N4 O8
chemicalCompound:moleculeId
73795
chemicalCompound:mwFreebase
773.054
chemicalCompound:alogp
4.75
chemicalCompound:hba
9
chemicalCompound:hbd
3
chemicalCompound:psa
138.9
chemicalCompound:rtb
23
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
1
chemicalCompound:medChemFri...
Y
chemicalCompound:acdLogP
4.47
chemicalCompound:acdLogD
4.42
chemicalCompound:molecularS...
chemicalCompound:fullMwt
773.054
chemicalCompound:acdMostBpk...
6.687
chemicalCompound:chemblId
CHEMBL51401
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