Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:standardIn...
InChI=1S/C41H54N8O7S/c1-24(2)20-31-38(53)45-30(17-19-57-3)37(52)44-29(15-16-35(42)50)36(51)46-32(22-26-23-43-28-13-8-7-12-27(26)28)39(54)48-33(21-25-10-5-4-6-11-25)41(56)49-18-9-14-34(49)40(55)47-31/h4-8,10-13,23-24,29-34,43H,9,14-22H2,1-3H3,(H2,42,50)(H,44,52)(H,45,53)(H,46,51)(H,47,55)(H,48,54)/t29-,30+,31-,32+,33-,34?/m0/s1
chemicalCompound:standardIn...
GSJQRVOGSIPXIA-UPBSBSFBSA-N
chemicalCompound:canonicalS...
CSCC[C@H]1NC(=O)[C@H](CC(C)C)NC(=O)C2CCCN2C(=O)[C@H](Cc3ccccc3)NC(=O)[C@@H](Cc4c[nH]c5ccccc45)NC(=O)[C@H](CCC(=O)N)NC1=O
chemicalCompound:molecularF...
C41 H54 N8 O7 S
chemicalCompound:moleculeId
20
chemicalCompound:mwFreebase
802.982
chemicalCompound:alogp
1.621
chemicalCompound:hba
8
chemicalCompound:hbd
7
chemicalCompound:psa
249.98
chemicalCompound:rtb
12
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
2
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
13
chemicalCompound:acdLogP
1.597
chemicalCompound:acdLogD
1.597
chemicalCompound:molecularS...
chemicalCompound:fullMwt
802.982
chemicalCompound:chemblId
CHEMBL267128
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