|
chemicalCompound:parent |
|
|
chemicalCompound:synonym |
|
|
chemicalCompound:standardIn... |
InChI=1S/Ca.2ClH/h;2*1H/q+2;;/p-2
|
|
chemicalCompound:standardIn... |
UXVMQQNJUSDDNG-UHFFFAOYSA-L
|
|
chemicalCompound:canonicalS... |
[Cl-].[Cl-].[Ca+2]
|
|
chemicalCompound:molecularF... |
CaCl2
|
|
chemicalCompound:moleculeId |
674619
|
|
chemicalCompound:mwFreebase |
482.66
|
|
chemicalCompound:alogp |
6.943
|
|
chemicalCompound:hba |
5
|
|
chemicalCompound:hbd |
3
|
|
chemicalCompound:psa |
70.07
|
|
chemicalCompound:rtb |
12
|
|
chemicalCompound:ro3Pass |
N
|
|
chemicalCompound:numRo5viol... |
1
|
|
chemicalCompound:medChemFri... |
N
|
|
chemicalCompound:acdMostApk... |
3.751
|
|
chemicalCompound:acdLogP |
6.336
|
|
chemicalCompound:acdLogD |
2.578
|
|
chemicalCompound:molecularS... |
|
|
chemicalCompound:fullMwt |
110.984
|
|
chemicalCompound:acdMostBpk... |
9.909
|
|
chemicalCompound:chemblId |
CHEMBL1200668
|
|
chemicalCompound:maxPhase |
4
|
|
chemicalCompound:therapeuti... |
0
|
|
chemicalCompound:dosedIngre... |
Yes
|
|
chemicalCompound:structureT... |
|
|
chemicalCompound:chebi |
|
|
chemicalCompound:moleculeTy... |
|
|
chemicalCompound:oral |
No
|
|
chemicalCompound:parenteral |
Yes
|
|
chemicalCompound:topical |
No
|
|
chemicalCompound:blackBoxWa... |
No
|
|
chemicalCompound:naturalPro... |
No
|
|
chemicalCompound:proDrug |
No
|
|
chemicalCompound:prefName |
CALCIUM CHLORIDE CA 47
|
|
chemicalCompound:chebiParen... |
|
