Preferred name
CALCIUM CHLORIDE
Synonyms
CaCl2 ()
Calcium dichloride ()
Dowflake ()
Calcium chloride hydrate ()
Calcium chloride anhydrous ()
Calcium chloride, anhydrous ()
Kalgan ()
Intergravin-orales ()
Peladow ()
Liquidow ()
E509 ()
NSC-759598 ()
Calcium chloride solution ()
E-509 ()
INS NO.509 ()
Calcium chloride dihydrate ()
Cacl2 (anhydrous) ()
Bovikalc ()
Cal Plus ()
INS-509 ()
Calcarea muriatica ()
P&D ID
PD009767
CAS
14639-81-7
10043-52-4
Tags
available
nuisance
drug
inorganic
Drug Status
approved
Max Phase
4.0
Drug indication
Radioactive Agent,Replenisher (calcium)
Structure
SMILES
[Ca+2].[Cl-].[Cl-]
InChI
InChI=1S/Ca.2ClH/h;2*1H/q+2;;/p-2
InChIkey
UXVMQQNJUSDDNG-UHFFFAOYSA-L
MOL
CALCIUM CHLORIDE
RDKit 2D
3 0 0 0 0 0 0 0 0 0999 V2000
0.0000 1.0000 0.0000 Ca 0 0 0 0 0 15 0 0 0 0 0 0
0.0000 0.0000 0.0000 Cl 0 0 0 0 0 15 0 0 0 0 0 0
1.0000 0.0000 0.0000 Cl 0 0 0 0 0 15 0 0 0 0 0 0
M CHG 3 1 2 2 -1 3 -1
M END
> <ID>
PD009767
> <Name>
CALCIUM CHLORIDE
0
0
0
8
ChEMBL Approved Drugs
ChEMBL Drugs
DrugBank
DrugBank Approved Drugs
Ki Database
Nuisance compounds in cellular assays
Selleckchem Bioactive Compound Library
The Spectrum Collection
3
36
ChEMBL CHEMBL1200668
ChEBI 3312
ChemicalBook CB3465202
ChemSpider 23237
CompTox DTXSID5020235
DailyMed CALCIUM CHLORIDE
DrugBank DB01164
FDA SRS OFM21057LP
GSRS 74deab72-7852-4...
HMDB HMDB0303526
KEGG C08130
MolPort MolPort-003-925-250
Nikkaji J43.724G
PharmGKB PA448729
Reactome 23237
SureChEMBL SCHEMBL3095
(calculated by RDKit )
Molecular Weight
109.9
Hydrogen Bond Acceptors
0
Hydrogen Bond Donors
0
Rotatable Bonds
0
Ring Count
0
Aromatic Ring Count
0
cLogP
-6.37
TPSA
0.0
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
0.0
QED
0.27
QED
0.27
1
Metal impurity
Nuisance compounds
(extracted from source data)
