201966

Source:http://linkedlifedata.com/resource/chembl/compound/201966

Download in:

Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C18H16O/c1-13(14-7-3-2-4-8-14)16-12-11-15-9-5-6-10-17(15)18(16)19/h2-13,19H,1H3
chemicalCompound:standardIn...	FCCNKTOSNRDETA-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(c1ccccc1)c2ccc3ccccc3c2O
chemicalCompound:molecularF...	C18 H16 O
chemicalCompound:moleculeId	201966
chemicalCompound:mwFreebase	248.319
chemicalCompound:alogp	4.722
chemicalCompound:hba	1
chemicalCompound:hbd	1
chemicalCompound:psa	20.23
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.567
chemicalCompound:acdLogP	4.886
chemicalCompound:acdLogD	4.883
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	248.319
chemicalCompound:chemblId	CHEMBL122986
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:301966
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:561204, activity:561205, activity:561206