|
rdf:type |
|
|
chemicalCompound:synonym |
|
|
chemicalCompound:standardIn... |
InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H
|
|
chemicalCompound:standardIn... |
KZNIFHPLKGYRTM-UHFFFAOYSA-N
|
|
chemicalCompound:canonicalS... |
Oc1ccc(cc1)C2=CC(=O)c3c(O)cc(O)cc3O2
|
|
chemicalCompound:molecularF... |
C15H10O5
|
|
chemicalCompound:moleculeId |
1564
|
|
chemicalCompound:mwFreebase |
270.237
|
|
chemicalCompound:alogp |
2.41
|
|
chemicalCompound:hba |
5
|
|
chemicalCompound:hbd |
3
|
|
chemicalCompound:psa |
86.99
|
|
chemicalCompound:rtb |
1
|
|
chemicalCompound:ro3Pass |
N
|
|
chemicalCompound:numRo5viol... |
0
|
|
chemicalCompound:medChemFri... |
Y
|
|
chemicalCompound:acdMostApk... |
6.525
|
|
chemicalCompound:acdLogP |
2.127
|
|
chemicalCompound:acdLogD |
0.935
|
|
chemicalCompound:molecularS... |
|
|
chemicalCompound:fullMwt |
270.237
|
|
chemicalCompound:chemblId |
CHEMBL28
|
|
chemicalCompound:maxPhase |
0
|
|
chemicalCompound:therapeuti... |
0
|
|
chemicalCompound:dosedIngre... |
No
|
|
chemicalCompound:structureT... |
|
|
chemicalCompound:chebi |
|
|
chemicalCompound:moleculeTy... |
|
|
chemicalCompound:oral |
No
|
|
chemicalCompound:parenteral |
No
|
|
chemicalCompound:topical |
No
|
|
chemicalCompound:blackBoxWa... |
No
|
|
chemicalCompound:naturalPro... |
No
|
|
chemicalCompound:proDrug |
No
|
|
chemicalCompound:prefName |
APIGENIN
|
|
chemicalCompound:chebiParen... |
|
|
chemicalCompound:activity |
activity:142769,
activity:273708,
activity:273709,
activity:273710,
activity:273711,
activity:679858,
activity:679859,
activity:679860,
activity:681442,
activity:687262,
activity:687263,
activity:688034,
activity:688035,
activity:688036,
activity:958087,
activity:958088,
activity:958089,
activity:1042218,
activity:1042219,
activity:1042220,
activity:1078330,
activity:1078331,
activity:1078332,
activity:1078333,
activity:1078334,
activity:1078335,
activity:1114677,
activity:1149564,
activity:1154876,
activity:1154877,
activity:1154878,
activity:1168235,
activity:1168236,
activity:1168237,
activity:1168238,
activity:1168239,
activity:1168240,
activity:1168241,
activity:1168242,
activity:1168243,
activity:1168244,
activity:1168245,
activity:1168246,
activity:1238252,
activity:1238253,
activity:1407656,
activity:1407657,
activity:1407658,
activity:1407659,
activity:1472549,
activity:1655421,
activity:1655422,
activity:1719286,
activity:1719287,
activity:1719410,
activity:1719411,
activity:1719412,
activity:1848233,
activity:1848241,
activity:1848253,
activity:1888537,
activity:1888544,
activity:1888566,
activity:1888590
|
