spironolactone

CAS:

Other names:

SMILES: CC(=O)S[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]45CCC(=O)O5)[C@H]13

Properties

MW	HBA	HBD	LogP	TPSA	Rot.	Comp.	Fsp3C	Brutto formula
416.57	5	0	4.85	85.74000000000001	2	84	0.79	C24H32O4S

Availability

Suppliers	Supplier IDs	Storage	Storage ID	Quantity	Class	Added
			NT_c0222	None		Jan. 1, 2023

Bar codes

Plate barcode	Sample barcode

PAINS

Identified PAINS
Not checked

Supramolecules

Name	log K	SD	pH	T(°C)	Method	Ref
[b-Cyclodextrin](1).[spironolactone]	4.39				phase solubility	Kaneto Uekama 1997
[b-Cyclodextrin](1).[spironolactone]	4.00		2.0	25.0	HPLC-method	Valentino J. Stella 2000
[g-Cyclodextrin](1).[spironolactone]	4.00				phase solubility	Kaneto Uekama 1997
[g-Cyclodextrin](1).[spironolactone]	3.68		2.0	25.0	HPLC-method	Valentino J. Stella 2000
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[spironolactone]	4.20				phase solubility	Kaneto Uekama 1997
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[spironolactone]	4.04		2.0	25.0	HPLC-method	Valentino J. Stella 2000
[2-O-(2-Hydroxy)propyl-g-Cyclodextrin](1).[spironolactone]	3.85				phase solubility	Kaneto Uekama 1997

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