|
rdf:type |
|
|
chemicalCompound:synonym |
|
|
chemicalCompound:standardIn... |
InChI=1S/C15H14O3/c1-11(15(16)17)12-6-5-9-14(10-12)18-13-7-3-2-4-8-13/h2-11H,1H3,(H,16,17)
|
|
chemicalCompound:standardIn... |
RDJGLLICXDHJDY-UHFFFAOYSA-N
|
|
chemicalCompound:canonicalS... |
CC(C(=O)O)c1cccc(Oc2ccccc2)c1
|
|
chemicalCompound:molecularF... |
C15H14O3
|
|
chemicalCompound:moleculeId |
255534
|
|
chemicalCompound:mwFreebase |
242.27
|
|
chemicalCompound:alogp |
3.517
|
|
chemicalCompound:hba |
3
|
|
chemicalCompound:hbd |
1
|
|
chemicalCompound:psa |
46.53
|
|
chemicalCompound:rtb |
4
|
|
chemicalCompound:ro3Pass |
N
|
|
chemicalCompound:numRo5viol... |
0
|
|
chemicalCompound:medChemFri... |
Y
|
|
chemicalCompound:acdMostApk... |
4.199
|
|
chemicalCompound:acdLogP |
3.723
|
|
chemicalCompound:acdLogD |
0.629
|
|
chemicalCompound:molecularS... |
|
|
chemicalCompound:fullMwt |
242.27
|
|
chemicalCompound:chemblId |
CHEMBL1297
|
|
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 |
FENOPROFEN
|
|
chemicalCompound:chebiParen... |
|
|
chemicalCompound:activity |
activity:112926,
activity:1707725,
activity:1707736,
activity:1707741,
activity:1918440,
activity:1926511,
activity:2302539,
activity:2303659,
activity:3468672,
activity:5196686,
activity:5196693,
activity:5328903,
activity:6074838,
activity:6074881,
activity:6174371,
activity:6261967,
activity:7564604,
activity:7564605,
activity:7564606,
activity:7564674,
activity:7564675,
activity:7564676,
activity:7564677,
activity:7564678,
activity:7566944,
activity:7646234,
activity:7646235,
activity:7646236,
activity:7646237,
activity:7646238,
activity:7646239,
activity:7646240,
activity:7646241,
activity:7646242,
activity:7646243,
activity:7646244,
activity:7646245,
activity:7646246,
activity:7646247,
activity:7646248,
activity:7646249,
activity:7646250,
activity:7646251,
activity:7646252,
activity:7646253,
activity:7646254,
activity:7646255,
activity:7646256,
activity:7646257,
activity:7646258,
activity:7646259,
activity:7646260,
activity:7646261,
activity:7646262,
activity:7646263,
activity:7646264,
activity:7646265,
activity:7646266,
activity:7646267
|
