508604

Source:http://linkedlifedata.com/resource/chembl/compound/508604

Download in:

Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:9333
chemicalCompound:synonym	synonym:508604_CI-970_RESEARCH_CODE, synonym:508604_Cognex_TRADE_NAME, synonym:508604_Tacrine Hydrochloride_USAN, synonym:508604_Tacrine Hydrochloride_USP, synonym:508604_Tacrine hydrochloride_FDA_ALTERNATIVE_NAME, synonym:508604_Tacrine_BAN, synonym:508604_Tacrine_INN
chemicalCompound:standardIn...	InChI=1S/C13H14N2.ClH/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13;/h1,3,5,7H,2,4,6,8H2,(H2,14,15);1H
chemicalCompound:standardIn...	ZUFVXZVXEJHHBN-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.Nc1c2CCCCc2nc3ccccc13
chemicalCompound:molecularF...	C13H15ClN2
chemicalCompound:moleculeId	508604
chemicalCompound:mwFreebase	198.264
chemicalCompound:alogp	2.79
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	38.9
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.561
chemicalCompound:acdLogD	0.507
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	234.725
chemicalCompound:acdMostBpk...	9.642
chemicalCompound:chemblId	CHEMBL1677
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:608604
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	TACRINE HYDROCHLORIDE
chemicalCompound:firstAppro...	1993
chemicalCompound:activity	activity:491106, activity:491107, activity:491108, activity:491109, activity:1147955, activity:1147956, activity:1147957, activity:1147958, activity:1147959, activity:1517918, activity:1517919, activity:1517920, activity:1998748, activity:1998756, activity:1998764, activity:1998772, activity:1998780, activity:2351180, activity:2351191, activity:2351202, activity:2351213, activity:2351219, activity:3481363, activity:3481388, activity:3481418, activity:3481432, activity:3481449, activity:3481465, activity:3482361, activity:3491220, activity:3635993, activity:3649251, activity:3688641, activity:3695205, activity:3911225, activity:3988107, activity:4017975, activity:4145903, activity:4278557, activity:4535863, activity:4538224, activity:4617634, activity:4641145, activity:4652017, activity:4725630, activity:4966403, activity:5025185, activity:5317866, activity:5318817, activity:5319768, activity:5706472, activity:5855644, activity:5875737, activity:5955048, activity:6166362, activity:6166398, activity:6167022