|
rdf:type |
|
|
chemicalCompound:synonym |
synonym:16415_AY-61123_RESEARCH_CODE,
synonym:16415_Atromid-S_TRADE_NAME,
synonym:16415_Chlorfenisate_OTHER,
synonym:16415_Clofibrate_BAN,
synonym:16415_Clofibrate_FDA_ALTERNATIVE_NAME,
synonym:16415_Clofibrate_INN,
synonym:16415_Clofibrate_JAN,
synonym:16415_Clofibrate_TRADE_NAME,
synonym:16415_Clofibrate_USAN,
synonym:16415_Clofibrate_USP,
synonym:16415_ICI-28257_RESEARCH_CODE
|
|
chemicalCompound:standardIn... |
InChI=1S/C12H15ClO3/c1-4-15-11(14)12(2,3)16-10-7-5-9(13)6-8-10/h5-8H,4H2,1-3H3
|
|
chemicalCompound:standardIn... |
KNHUKKLJHYUCFP-UHFFFAOYSA-N
|
|
chemicalCompound:canonicalS... |
CCOC(=O)C(C)(C)Oc1ccc(Cl)cc1
|
|
chemicalCompound:molecularF... |
C12H15ClO3
|
|
chemicalCompound:moleculeId |
16415
|
|
chemicalCompound:mwFreebase |
242.699
|
|
chemicalCompound:alogp |
3.329
|
|
chemicalCompound:hba |
3
|
|
chemicalCompound:hbd |
0
|
|
chemicalCompound:psa |
35.53
|
|
chemicalCompound:rtb |
5
|
|
chemicalCompound:ro3Pass |
N
|
|
chemicalCompound:numRo5viol... |
0
|
|
chemicalCompound:medChemFri... |
Y
|
|
chemicalCompound:acdLogP |
3.88
|
|
chemicalCompound:acdLogD |
3.88
|
|
chemicalCompound:fullMwt |
242.699
|
|
chemicalCompound:chemblId |
CHEMBL565
|
|
chemicalCompound:maxPhase |
4
|
|
chemicalCompound:therapeuti... |
1
|
|
chemicalCompound:dosedIngre... |
Yes
|
|
chemicalCompound:structureT... |
|
|
chemicalCompound:chebi |
|
|
chemicalCompound:moleculeTy... |
|
|
chemicalCompound:oral |
Yes
|
|
chemicalCompound:parenteral |
No
|
|
chemicalCompound:topical |
No
|
|
chemicalCompound:blackBoxWa... |
No
|
|
chemicalCompound:naturalPro... |
No
|
|
chemicalCompound:proDrug |
Yes
|
|
chemicalCompound:prefName |
CLOFIBRATE
|
|
chemicalCompound:chebiParen... |
|
|
chemicalCompound:activity |
activity:38951,
activity:38952,
activity:38953,
activity:38954,
activity:38955,
activity:38956,
activity:48268,
activity:54196,
activity:54197,
activity:54198,
activity:54199,
activity:54200,
activity:54201,
activity:54202,
activity:54203,
activity:54204,
activity:54205,
activity:54206,
activity:62625,
activity:62626,
activity:62627,
activity:62628,
activity:62629,
activity:62630,
activity:198333,
activity:198334,
activity:198335,
activity:216354,
activity:216355,
activity:216356,
activity:216357,
activity:226563,
activity:226564,
activity:226565,
activity:226566,
activity:274906,
activity:274907,
activity:274908,
activity:289502,
activity:289503,
activity:289504,
activity:289505,
activity:289506,
activity:289507,
activity:325999,
activity:326000,
activity:326001,
activity:326002,
activity:326003,
activity:326004,
activity:326005,
activity:326006,
activity:326007,
activity:326008,
activity:326009,
activity:460019
|
