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rdf:type |
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chemicalCompound:parent |
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chemicalCompound:synonym |
synonym:452635_Adamantanamine Hydrochloride_OTHER,
synonym:452635_Amantadine Hydrochloride_JAN,
synonym:452635_Amantadine Hydrochloride_USAN,
synonym:452635_Amantadine Hydrochloride_USP,
synonym:452635_Amantadine hydrochloride_FDA_ALTERNATIVE_NAME,
synonym:452635_Amantadine hydrochloride_TRADE_NAME,
synonym:452635_Amantadine_BAN,
synonym:452635_Amantadine_INN,
synonym:452635_EXP-105-1_RESEARCH_CODE,
synonym:452635_Symadine_TRADE_NAME,
synonym:452635_Symmetrel_TRADE_NAME
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chemicalCompound:standardIn... |
InChI=1S/C10H17N.ClH/c11-10-4-7-1-8(5-10)3-9(2-7)6-10;/h7-9H,1-6,11H2;1H
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chemicalCompound:standardIn... |
WOLHOYHSEKDWQH-UHFFFAOYSA-N
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chemicalCompound:canonicalS... |
Cl.NC12CC3CC(CC(C3)C1)C2
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chemicalCompound:molecularF... |
C10H18ClN
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chemicalCompound:moleculeId |
452635
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chemicalCompound:mwFreebase |
151.249
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chemicalCompound:alogp |
1.495
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chemicalCompound:hba |
1
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chemicalCompound:hbd |
1
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chemicalCompound:psa |
26.02
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chemicalCompound:rtb |
0
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chemicalCompound:ro3Pass |
Y
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chemicalCompound:numRo5viol... |
0
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chemicalCompound:medChemFri... |
Y
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chemicalCompound:acdLogP |
2.442
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chemicalCompound:acdLogD |
-0.467
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chemicalCompound:molecularS... |
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chemicalCompound:fullMwt |
187.71
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chemicalCompound:acdMostBpk... |
10.756
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chemicalCompound:chemblId |
CHEMBL1569
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chemicalCompound:maxPhase |
4
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chemicalCompound:therapeuti... |
1
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chemicalCompound:dosedIngre... |
Yes
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chemicalCompound:structureT... |
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chemicalCompound:chebi |
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chemicalCompound:moleculeTy... |
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chemicalCompound:oral |
Yes
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chemicalCompound:parenteral |
No
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chemicalCompound:topical |
No
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chemicalCompound:blackBoxWa... |
No
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chemicalCompound:naturalPro... |
No
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chemicalCompound:proDrug |
No
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chemicalCompound:prefName |
AMANTADINE HYDROCHLORIDE
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chemicalCompound:chebiParen... |
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chemicalCompound:activity |
activity:486222,
activity:486223,
activity:486224,
activity:1952076,
activity:1952089,
activity:2113040,
activity:2113041,
activity:2586106,
activity:2586107,
activity:2586122,
activity:2586156,
activity:2586157,
activity:2586158,
activity:2586159,
activity:3473528,
activity:3489259,
activity:3489339,
activity:3626354,
activity:3635035,
activity:3693351,
activity:3988022,
activity:4014840,
activity:4278483,
activity:4358299,
activity:4422174,
activity:4535798,
activity:4745870,
activity:4921750,
activity:5316387,
activity:5316513,
activity:5761223,
activity:7477107,
activity:7499072,
activity:7527872
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