675

Source:http://linkedlifedata.com/resource/chembl/compound/675

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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:675_EPIBATIDINE_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2
chemicalCompound:standardIn...	NLPRAJRHRHZCQQ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Clc1ccc(cn1)C2CC3CCC2N3
chemicalCompound:molecularF...	C11H13ClN2
chemicalCompound:moleculeId	675
chemicalCompound:mwFreebase	208.687
chemicalCompound:alogp	1.838
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	24.92
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.98
chemicalCompound:acdLogD	-0.503
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	208.687
chemicalCompound:acdMostBpk...	10.07
chemicalCompound:chemblId	CHEMBL6623
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:100675
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	EPIBATIDINE
chemicalCompound:activity	activity:67136, activity:77360, activity:77361, activity:77362, activity:77363, activity:77364, activity:77365, activity:77366, activity:77367, activity:77368, activity:77369, activity:77370, activity:77371, activity:77372, activity:77373, activity:77374, activity:77375, activity:77376, activity:77377, activity:97319, activity:97320, activity:188593, activity:188594, activity:188595, activity:188596, activity:227249, activity:276161, activity:276162, activity:276163, activity:276164, activity:276165, activity:276166, activity:276167, activity:276168, activity:276169, activity:276170, activity:276171, activity:282233, activity:282234, activity:282235, activity:282236, activity:282237, activity:282238, activity:282239, activity:282240, activity:282241, activity:282242, activity:282243, activity:290160, activity:290161, activity:290162, activity:352196, activity:352197, activity:352198, activity:352199, activity:352200, activity:352201, activity:451518, activity:451519, activity:451520, activity:476190, activity:476191, activity:494504, activity:626793, activity:626794