rdf:type |
|
chemicalCompound:parent |
|
chemicalCompound:standardIn... |
InChI=1S/C3H3NS.ClH/c1-2-5-3-4-1;/h1-3H;1H
|
chemicalCompound:standardIn... |
ORECNKBJIMKZNX-UHFFFAOYSA-N
|
chemicalCompound:canonicalS... |
Cl.c1cscn1
|
chemicalCompound:molecularF... |
C3H4ClNS
|
chemicalCompound:moleculeId |
61277
|
chemicalCompound:mwFreebase |
85.1276
|
chemicalCompound:alogp |
0.285
|
chemicalCompound:hba |
1
|
chemicalCompound:hbd |
0
|
chemicalCompound:psa |
41.13
|
chemicalCompound:rtb |
0
|
chemicalCompound:ro3Pass |
Y
|
chemicalCompound:numRo5viol... |
0
|
chemicalCompound:medChemFri... |
Y
|
chemicalCompound:acdLogP |
0.44
|
chemicalCompound:acdLogD |
0.44
|
chemicalCompound:molecularS... |
|
chemicalCompound:fullMwt |
121.589
|
chemicalCompound:acdMostBpk... |
2.72
|
chemicalCompound:chemblId |
CHEMBL43686
|
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 |
HYDROCHLORTHIAZIDE
|
chemicalCompound:activity |
|