Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:standardIn...
InChI=1S/C37H50FN11O5S/c1-21(2)18-28(33(52)46-27(32(39)51)6-4-16-44-36(40)41)47-34(53)29(19-23-10-14-26(15-11-23)45-37(42)43)48-35(54)30(20-24-8-12-25(38)13-9-24)49(22(3)50)31-7-5-17-55-31/h5,7-15,17,21,27-30H,4,6,16,18-20H2,1-3H3,(H2,39,51)(H,46,52)(H,47,53)(H,48,54)(H4,40,41,44)(H4,42,43,45)
chemicalCompound:standardIn...
WZUBLVBDYOKRIZ-UHFFFAOYSA-N
chemicalCompound:canonicalS...
CC(C)CC(NC(=O)C(Cc1ccc(NC(=N)N)cc1)NC(=O)C(Cc2ccc(F)cc2)N(C(=O)C)c3cccs3)C(=O)NC(CCCN=C(N)N)C(=O)N
chemicalCompound:molecularF...
C37 H50 F N11 O5 S
chemicalCompound:moleculeId
241154
chemicalCompound:mwFreebase
779.927
chemicalCompound:alogp
1.757
chemicalCompound:hba
9
chemicalCompound:hbd
9
chemicalCompound:psa
305.23
chemicalCompound:rtb
21
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
2
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
12.791
chemicalCompound:acdLogP
2.984
chemicalCompound:acdLogD
-0.015
chemicalCompound:molecularS...
chemicalCompound:fullMwt
779.927
chemicalCompound:acdMostBpk...
13.338
chemicalCompound:chemblId
CHEMBL422838
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