Statements in which the resource exists as a subject.
PredicateObject
rdf:type
chemicalCompound:parent
chemicalCompound:standardIn...
InChI=1S/C35H64N8O4.4ClH/c1-2-3-4-5-6-15-24-41-34(46)31(26-27-17-8-7-9-18-27)43-35(47)30(42-33(45)29(39)20-11-14-23-37)21-12-16-25-40-32(44)28(38)19-10-13-22-36;;;;/h7-9,17-18,28-31H,2-6,10-16,19-26,36-39H2,1H3,(H,40,44)(H,41,46)(H,42,45)(H,43,47);4*1H/t28-,29-,30-,31-;;;;/m0..../s1
chemicalCompound:standardIn...
IOMGQKRYIDODGA-ROVKJLEASA-N
chemicalCompound:canonicalS...
Cl.Cl.Cl.Cl.CCCCCCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCNC(=O)[C@@H](N)CCCCN)NC(=O)[C@@H](N)CCCCN
chemicalCompound:molecularF...
C35H68Cl4N8O4
chemicalCompound:moleculeId
1279071
chemicalCompound:mwFreebase
660.934
chemicalCompound:alogp
2
chemicalCompound:hba
8
chemicalCompound:hbd
8
chemicalCompound:psa
220.48
chemicalCompound:rtb
28
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
2
chemicalCompound:medChemFri...
N
chemicalCompound:acdMostApk...
13.822
chemicalCompound:acdLogP
3.171
chemicalCompound:acdLogD
-1.627
chemicalCompound:molecularS...
chemicalCompound:fullMwt
806.778
chemicalCompound:acdMostBpk...
10.48
chemicalCompound:chemblId
CHEMBL1950098
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