| chemicalCompound:745525 | rdf:type | chembl:ChemicalCompound | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:standardIn... | InChI=1S/C12H16N6O2/c13-9-10-14-11(17-1-5-19-6-2-17)16-12(15-10)18-3-7-20-8-4-18/h1-8H2 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:standardIn... | CKVMWRXMHJHOBH-UHFFFAOYSA-N | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:canonicalS... | N#Cc1nc(nc(n1)N2CCOCC2)N3CCOCC3 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:molecularF... | C12H16N6O2 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:moleculeId | 745525 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:mwFreebase | 276.294 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:alogp | -0.572 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:hba | 8 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:hbd | 0 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:psa | 87.4 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:rtb | 2 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:ro3Pass | N | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:numRo5viol... | 0 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:medChemFri... | Y | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:acdLogP | 0 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:acdLogD | 0 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:molecularS... | molecularSpecies:NEUTRAL | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:fullMwt | 276.294 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:acdMostBpk... | 4.358 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:chemblId | CHEMBL1321641 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:maxPhase | 0 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:therapeuti... | 0 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:dosedIngre... | No | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:structureT... | structureType:MOL | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:chebi | https://linkedlifedata.com/... | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:moleculeTy... | moleculeType:Small molecule | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:oral | No | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:parenteral | No | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:topical | No | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:blackBoxWa... | No | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:naturalPro... | No | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:proDrug | No | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:activity | activity:3976801 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:activity | activity:4277768 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:activity | activity:4277799 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:activity | activity:4541013 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:activity | activity:4541076 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:activity | activity:4549786 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:activity | activity:4836042 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:activity | activity:4872561 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:activity | activity:7122002 | lld:chembl |
| chemicalCompound:745525 | chemicalCompound:activity | activity:7483433 | lld:chembl |
| http://linkedlifedata.com/r... | http://linkedlifedata.com/r... | chemicalCompound:745525 | lld:chembl |
| http://linkedlifedata.com/r... | http://linkedlifedata.com/r... | chemicalCompound:745525 | lld:chembl |
