General Information of the Compound
Compound ID
CP0072338
Compound Name
Anadrol
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Synonyms
434-07-1
Adroidin
Adroyd
Anadrol
Anadrol-50
Anadroyd
Anapolon
Anapolon 50
Anasteron
Anasteronal
Anasterone
Becorel
CCRIS 492
CI 406
CI-406
Dynasten
EINECS 207-098-6
HMS3393H15
HSDB 3374
Methabol
Nastenon
Ossimetolone [DCIT]
Oximetalonu
Oximetholone
Oximetholonum
Oximetolona
Oximetolona [INN-Spanish]
Oxitosona-50
Oxymethalone
Oxymethenolone
Oxymetholone
Oxymetholonum
Oxymetholonum [INN-Latin]
Pavisoid
Plenastril
Protanabol
Roboral
Synasteron
UNII-L76T0ZCA8K
Zenalosyn
oxymetholone
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Structure
Formula
C21H32O3
Molecular Weight
332.484
Canonical SMILES
C[C@]1(O)CC[C@H]2[C@@H]3CC[C@H]4CC(=O)\C(C[C@]4(C)[C@H]3CC[C@]12C)=C/O
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InChI
InChI=1S/C21H32O3/c1-19-11-13(12-22)18(23)10-14(19)4-5-15-16(19)6-8-20(2)17(15)7-9-21(20,3)24/h12,14-17,22,24H,4-11H2,1-3H3/b13-12-/t14-,15+,16-,17-,19-,20-,21-/m0/s1
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InChIKey
ICMWWNHDUZJFDW-DHODBPELSA-N
CAS
434-07-1
Physicochemical Property
logP
4.401
Rotatable Bonds
0
Heavy Atom Count
24
Polar Areas
57.53
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Complexity
24

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 5281034
ChEMBL ID
CHEMBL1200585
DrugBank ID
DB06412
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT04542, Bile salt export pump
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 48700 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Protein ID: PT06109, Geminin
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000015 SW480
 Cell Line Info 
Homo sapiens (Human)  1
1
Potency ~ 33498.3 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( Oxymetholone )
Drug Name Oxymetholone
Company Solvay Pharmaceuticals
Indication
Aplastic anemia
Approved
Drug 2 ( Oxymethalone )
Drug Name Oxymethalone
Indication
Coronavirus Disease 2019 (COVID-19)
Investigative