|
rdf:type |
|
|
chemicalCompound:standardIn... |
InChI=1S/H3NO/c1-2/h2H,1H2
|
|
chemicalCompound:standardIn... |
AVXURJPOCDRRFD-UHFFFAOYSA-N
|
|
chemicalCompound:canonicalS... |
NO
|
|
chemicalCompound:molecularF... |
H3NO
|
|
chemicalCompound:moleculeId |
665311
|
|
chemicalCompound:mwFreebase |
33.0299
|
|
chemicalCompound:alogp |
-0.687
|
|
chemicalCompound:hba |
2
|
|
chemicalCompound:hbd |
2
|
|
chemicalCompound:psa |
46.25
|
|
chemicalCompound:rtb |
0
|
|
chemicalCompound:ro3Pass |
Y
|
|
chemicalCompound:numRo5viol... |
0
|
|
chemicalCompound:medChemFri... |
Y
|
|
chemicalCompound:acdMostApk... |
13.7
|
|
chemicalCompound:acdLogP |
-0.758
|
|
chemicalCompound:acdLogD |
-0.774
|
|
chemicalCompound:molecularS... |
|
|
chemicalCompound:fullMwt |
33.0299
|
|
chemicalCompound:acdMostBpk... |
5.97
|
|
chemicalCompound:chemblId |
CHEMBL1191361
|
|
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 |
HYDROXYAMINE
|
|
chemicalCompound:chebiParen... |
|
|
chemicalCompound:activity |
activity:3672007,
activity:4454656,
activity:4585289,
activity:4807369,
activity:4882124,
activity:5763458,
activity:5777100,
activity:5796032,
activity:5976282,
activity:6000087,
activity:6010206,
activity:6013495,
activity:6025626,
activity:6050501,
activity:6783892,
activity:7431780,
activity:7510176,
activity:7529960
|
