Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:standardIn...
InChI=1S/C34H42BrN5O6/c1-21-29(39-31(41)22(2)38-21)8-5-17-37-33(43)30(40-32(42)25-13-9-24(19-36)10-14-25)18-23-11-15-27(16-12-23)46-34(44)45-20-26-6-3-4-7-28(26)35/h3-4,6-7,11-12,15-16,24-25,30H,5,8-10,13-14,17-20,36H2,1-2H3,(H,37,43)(H,39,41)(H,40,42)/t24?,25-,30?
chemicalCompound:standardIn...
RFLYHWNKLJYUFZ-BZRIWBPJSA-N
chemicalCompound:canonicalS...
Cc1nc(C)c(CCCNC(=O)C(Cc2ccc(OC(=O)OCc3ccccc3Br)cc2)NC(=O)C4CCC(CN)CC4)nc1O
chemicalCompound:molecularF...
C34 H42 Br N5 O6
chemicalCompound:moleculeId
111970
chemicalCompound:mwFreebase
696.631
chemicalCompound:alogp
5.076
chemicalCompound:hba
9
chemicalCompound:hbd
4
chemicalCompound:psa
165.76
chemicalCompound:rtb
15
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
2
chemicalCompound:medChemFri...
Y
chemicalCompound:acdLogP
2.825
chemicalCompound:acdLogD
-0.532
chemicalCompound:molecularS...
chemicalCompound:fullMwt
696.631
chemicalCompound:acdMostBpk...
10.271
chemicalCompound:chemblId
CHEMBL307021
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