182165

Source:http://linkedlifedata.com/resource/chembl/compound/182165

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,14-17,19,22,24H,3-8,10-11H2,1-2H3/t14-,15-,16+,17-,19+,20-,21-/m0/s1
chemicalCompound:standardIn...	OMFXVFTZEKFJBZ-HJTSIMOOSA-N
chemicalCompound:canonicalS...	C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO
chemicalCompound:molecularF...	C21H30O4
chemicalCompound:moleculeId	182165
chemicalCompound:mwFreebase	346.461
chemicalCompound:alogp	2.019
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	74.59
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	12.977
chemicalCompound:acdLogP	1.952
chemicalCompound:acdLogD	1.952
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	346.461
chemicalCompound:chemblId	CHEMBL110739
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:282165
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	CORTICOSTERONE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:16827
chemicalCompound:activity	activity:40745, activity:40746, activity:42953, activity:42954, activity:57108, activity:57109, activity:149004, activity:199655, activity:227358, activity:227359, activity:227360, activity:227361, activity:232139, activity:232140, activity:259500, activity:259501, activity:293428, activity:390630, activity:399967, activity:460390, activity:460391, activity:460392, activity:460393, activity:460394, activity:460395, activity:460396, activity:460397, activity:460398, activity:460399, activity:514483, activity:514484, activity:624861, activity:624862, activity:646594, activity:785704, activity:926360, activity:950012, activity:955302, activity:985104, activity:985105, activity:1040402, activity:1191089, activity:1244248, activity:1483714, activity:1483715, activity:1483716, activity:1504421, activity:1605646, activity:1737915, activity:1738015, activity:1738020, activity:1738022, activity:1879206, activity:1879361, activity:1879362, activity:1879451, activity:2055402, activity:2055439, activity:2055498, activity:2058666, activity:2155684, activity:2211948, activity:2364220, activity:2385461, activity:2530016