|
rdf:type |
|
|
chemicalCompound:synonym |
|
|
chemicalCompound:standardIn... |
InChI=1S/C10H17N/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6,11H2
|
|
chemicalCompound:standardIn... |
DKNWSYNQZKUICI-UHFFFAOYSA-N
|
|
chemicalCompound:canonicalS... |
NC12CC3CC(CC(C3)C1)C2
|
|
chemicalCompound:molecularF... |
C10H17N
|
|
chemicalCompound:moleculeId |
27647
|
|
chemicalCompound:mwFreebase |
151.249
|
|
chemicalCompound:alogp |
1.495
|
|
chemicalCompound:hba |
1
|
|
chemicalCompound:hbd |
1
|
|
chemicalCompound:psa |
26.02
|
|
chemicalCompound:rtb |
0
|
|
chemicalCompound:ro3Pass |
Y
|
|
chemicalCompound:numRo5viol... |
0
|
|
chemicalCompound:medChemFri... |
Y
|
|
chemicalCompound:acdLogP |
2.442
|
|
chemicalCompound:acdLogD |
-0.467
|
|
chemicalCompound:molecularS... |
|
|
chemicalCompound:fullMwt |
151.249
|
|
chemicalCompound:acdMostBpk... |
10.756
|
|
chemicalCompound:chemblId |
CHEMBL660
|
|
chemicalCompound:maxPhase |
4
|
|
chemicalCompound:therapeuti... |
1
|
|
chemicalCompound:dosedIngre... |
No
|
|
chemicalCompound:structureT... |
|
|
chemicalCompound:chebi |
|
|
chemicalCompound:moleculeTy... |
|
|
chemicalCompound:oral |
Yes
|
|
chemicalCompound:parenteral |
No
|
|
chemicalCompound:topical |
No
|
|
chemicalCompound:blackBoxWa... |
No
|
|
chemicalCompound:naturalPro... |
No
|
|
chemicalCompound:proDrug |
No
|
|
chemicalCompound:prefName |
AMANTADINE
|
|
chemicalCompound:chebiParen... |
|
|
chemicalCompound:activity |
activity:193851,
activity:193852,
activity:193853,
activity:193854,
activity:193855,
activity:193856,
activity:193857,
activity:368709,
activity:368710,
activity:368711,
activity:389920,
activity:389921,
activity:389922,
activity:419793,
activity:419794,
activity:421316,
activity:463604,
activity:463605,
activity:463606,
activity:509312,
activity:509313,
activity:509314,
activity:509315,
activity:509316,
activity:529215,
activity:529216,
activity:529217,
activity:529218,
activity:529219,
activity:529220,
activity:575368,
activity:575369,
activity:606571,
activity:611199,
activity:611200,
activity:700396,
activity:700397,
activity:700398,
activity:700399,
activity:801176,
activity:801177,
activity:801178,
activity:801179,
activity:801180,
activity:846637,
activity:883266,
activity:883267,
activity:883268,
activity:883269,
activity:923706,
activity:938103,
activity:938104,
activity:938105,
activity:938106,
activity:938107,
activity:980755,
activity:980756,
activity:980757,
activity:980758,
activity:1911337,
activity:2037705
|
