Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:standardIn...
InChI=1S/C42H54FN9O6/c1-25(2)19-28(21-31(53)24-49-40(57)36(20-26-9-4-3-5-10-26)52-38(55)27-14-16-30(43)17-15-27)39(56)50-34(13-8-18-47-42(45)46)41(58)51-35(37(44)54)22-29-23-48-33-12-7-6-11-32(29)33/h3-7,9-12,14-17,23,25,28,31,34-36,48,53H,8,13,18-22,24H2,1-2H3,(H2,44,54)(H,49,57)(H,50,56)(H,51,58)(H,52,55)(H4,45,46,47)/t28-,31+,34+,35+,36+/m1/s1
chemicalCompound:standardIn...
GCPYOJSLSJRNKG-BCJWCAIOSA-N
chemicalCompound:canonicalS...
CC(C)C[C@H](C[C@H](O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c2ccc(F)cc2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N
chemicalCompound:molecularF...
C42H54FN9O6
chemicalCompound:moleculeId
515812
chemicalCompound:mwFreebase
799.933
chemicalCompound:alogp
3.15
chemicalCompound:hba
7
chemicalCompound:hbd
10
chemicalCompound:psa
257.41
chemicalCompound:rtb
23
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
2
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
13.198
chemicalCompound:acdLogP
3.001
chemicalCompound:acdLogD
1
chemicalCompound:molecularS...
chemicalCompound:fullMwt
799.933
chemicalCompound:acdMostBpk...
13.341
chemicalCompound:chemblId
CHEMBL453956
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