94790

Source:http://linkedlifedata.com/resource/chembl/compound/94790

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:94790_Carbachol_FDA_ALTERNATIVE_NAME, synonym:94790_Carbachol_USAN, synonym:94790_Carbastat_OTHER, synonym:94790_Isopto Carbachol_TRADE_NAME, synonym:94790_Miostat_OTHER
chemicalCompound:standardIn...	InChI=1S/C6H14N2O2/c1-8(2,3)4-5-10-6(7)9/h4-5H2,1-3H3,(H-,7,9)/p+1
chemicalCompound:standardIn...	VPJXQGSRWJZDOB-UHFFFAOYSA-O
chemicalCompound:canonicalS...	C[N+](C)(C)CCOC(=O)N
chemicalCompound:molecularF...	C6H15N2O2
chemicalCompound:moleculeId	94790
chemicalCompound:mwFreebase	147.195
chemicalCompound:alogp	-1.406
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	52.32
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	12.54
chemicalCompound:acdLogP	-4.096
chemicalCompound:acdLogD	-4.096
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	147.195
chemicalCompound:chemblId	CHEMBL965
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:194790
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:3665809, activity:3936196, activity:4006300, activity:5515736, activity:5776978, activity:5994032, activity:6001908, activity:6019012, activity:6022297, activity:6029228, activity:6032526, activity:6034477, activity:6034894, activity:6035797, activity:6063047, activity:7072752