|
rdf:type |
|
|
chemicalCompound:synonym |
|
|
chemicalCompound:standardIn... |
InChI=1S/C6H6O2/c7-5-1-2-6(8)4-3-5/h1-4,7-8H
|
|
chemicalCompound:standardIn... |
QIGBRXMKCJKVMJ-UHFFFAOYSA-N
|
|
chemicalCompound:canonicalS... |
Oc1ccc(O)cc1
|
|
chemicalCompound:molecularF... |
C6H6O2
|
|
chemicalCompound:moleculeId |
13329
|
|
chemicalCompound:mwFreebase |
110.111
|
|
chemicalCompound:alogp |
1.346
|
|
chemicalCompound:hba |
2
|
|
chemicalCompound:hbd |
2
|
|
chemicalCompound:psa |
40.46
|
|
chemicalCompound:rtb |
0
|
|
chemicalCompound:ro3Pass |
Y
|
|
chemicalCompound:numRo5viol... |
0
|
|
chemicalCompound:medChemFri... |
Y
|
|
chemicalCompound:acdMostApk... |
10.329
|
|
chemicalCompound:acdLogP |
0.62
|
|
chemicalCompound:acdLogD |
0.62
|
|
chemicalCompound:molecularS... |
|
|
chemicalCompound:fullMwt |
110.111
|
|
chemicalCompound:chemblId |
CHEMBL537
|
|
chemicalCompound:maxPhase |
4
|
|
chemicalCompound:therapeuti... |
0
|
|
chemicalCompound:dosedIngre... |
Yes
|
|
chemicalCompound:structureT... |
|
|
chemicalCompound:chebi |
|
|
chemicalCompound:moleculeTy... |
|
|
chemicalCompound:oral |
No
|
|
chemicalCompound:parenteral |
No
|
|
chemicalCompound:topical |
Yes
|
|
chemicalCompound:blackBoxWa... |
No
|
|
chemicalCompound:naturalPro... |
No
|
|
chemicalCompound:proDrug |
No
|
|
chemicalCompound:prefName |
HYDROQUINONE
|
|
chemicalCompound:chebiParen... |
|
|
chemicalCompound:firstAppro... |
2002
|
|
chemicalCompound:activity |
activity:787959,
activity:787960,
activity:787961,
activity:787962,
activity:787963,
activity:787964,
activity:1845308,
activity:1845430,
activity:1879136,
activity:1879157,
activity:1879264,
activity:1879265,
activity:1879403,
activity:1879599,
activity:2013022,
activity:2043602,
activity:2172141,
activity:2172305,
activity:2172315,
activity:2172327,
activity:2252264,
activity:2252270,
activity:2252276,
activity:2252282,
activity:2252288,
activity:2252294,
activity:2252300,
activity:2252305,
activity:2252309,
activity:2252315,
activity:2284707,
activity:2284714,
activity:2284728,
activity:2313857,
activity:2315413,
activity:2315437,
activity:2315463,
activity:2315479,
activity:2315506,
activity:2315542,
activity:2315568,
activity:2320343,
activity:2320344,
activity:2320345,
activity:2320346,
activity:2320347,
activity:2320348,
activity:2320349,
activity:2320350,
activity:2320351,
activity:2320352,
activity:2320353,
activity:2320354,
activity:2320355,
activity:2320356,
activity:2320357,
activity:2320358,
activity:2330099,
activity:2330100,
activity:2331010,
activity:2385339
|
