General
Preferred name
CALCIUM SULFATE
Synonyms
Basic calcium sulfate ()
Native calcium sulfate ()
Anhydrous gypsum ()
Calcium sulfate anhydrous ()
NSC-529649 ()
Calcium sulfate, unspecified form ()
Light spar ()
Ci 77231 ()
Mineral white ()
Precipitated calcium sulphate ()
Calcium sulfate, anhydrous ()
Shi gao ()
Anhydrous sulphate of lime ()
Insoluble anhydrite ()
Calcium sulphate, anhydrous ()
E-516 ()
Denka sigma 1000 ()
Muriacite ()
Calcarea sulphurica ()
Calcium (as sulfate) ()
INS NO.516 ()
Dead-burned gypsum ()
Sulfuric acid calcium salt (1:1) ()
Calcii sulfas ()
Calcium sulphate anhydrous (e516) ()
Terra alba ()
Anhydrite ()
Stone paste ()
Gypsum fibrosum ()
Calcium sulphate anhydrous ()
Karstenite ()
Raddichem 27 ()
Calcium sulphate ()
Satin spar ()
Calcium sulfate (1:1) dihydrate ()
Satinite ()
Alabaster ()
Anhydrous sulfate of lime ()
Native calcium sulphate ()
Shigao ()
Calmatrix ()
Precipitated calcium sulfate ()
Gypsum ()
Calcium sulfate dihydrate ()
INS-516 ()
P&D ID
PD124835
CAS
7778-18-9
146522-67-0
Tags
drug candidate
inorganic
Drug Status
experimental
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Compound Sets
2
ChEMBL Drugs
CHEMBL2106140
DrugBank
DB15533
External IDs
24
Properties
(calculated by RDKit )
Molecular Weight
135.91
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
0
Rotatable Bonds
0
Ring Count
0
Aromatic Ring Count
0
cLogP
-1.72
TPSA
80.26
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
0.0
QED
0.23
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data