674586

Source:http://linkedlifedata.com/resource/chembl/compound/674586

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:parent	chemicalCompound:675214
chemicalCompound:synonym	synonym:674586_Hydrocortamate chloride_INN
chemicalCompound:standardIn...	InChI=1S/C27H41NO6.ClH/c1-5-28(6-2)15-23(32)34-16-22(31)27(33)12-10-20-19-8-7-17-13-18(29)9-11-25(17,3)24(19)21(30)14-26(20,27)4;/h13,19-21,24,30,33H,5-12,14-16H2,1-4H3;1H/t19-,20-,21-,24+,25-,26-,27-;/m0./s1
chemicalCompound:standardIn...	AKQNAIYKSALPKV-OYHXESGYSA-N
chemicalCompound:canonicalS...	Cl.CCN(CC)CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C
chemicalCompound:molecularF...	C27H42ClNO6
chemicalCompound:moleculeId	674586
chemicalCompound:mwFreebase	475.618
chemicalCompound:alogp	2.366
chemicalCompound:hba	7
chemicalCompound:hbd	2
chemicalCompound:psa	104.14
chemicalCompound:rtb	8
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	12.317
chemicalCompound:acdLogP	3.36
chemicalCompound:acdLogD	2.608
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	512.078
chemicalCompound:acdMostBpk...	8.077
chemicalCompound:chemblId	CHEMBL1200635
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:774586
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	Yes
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	Yes
chemicalCompound:proDrug	No
chemicalCompound:prefName	HYDROCORTAMATE CHLORIDE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:50854