DANAZOL


SMILES C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=Cc5oncc5C[C@]4(C)[C@H]3CC[C@@]21C
InChIKey POZRVZJJTULAOH-LHZXLZLDSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 0
Molecular weight (Da) 337.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK2 NK2R Human Tachykinin A pKi 5.05 5.05 5.05 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 4.98 4.98 4.98 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 5.46 5.46 5.46 ChEMBL
β3 ADRB3 Human Adrenoceptors A pKi 4.89 4.89 4.89 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 5.42 5.42 5.42 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 5.16 5.16 5.16 ChEMBL
D1 DRD1 Human Dopamine A pKi 4.99 4.99 4.99 ChEMBL
D3 DRD3 Human Dopamine A pKi 5.01 5.01 5.01 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 5.6 5.6 5.6 ChEMBL
A3 AA3R Human Adenosine A pKi 5.2 5.2 5.2 ChEMBL
κ OPRK Human Opioid A pKi 5.21 5.21 5.21 ChEMBL
μ OPRM Human Opioid A pKi 5.24 5.24 5.24 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 8.25 8.25 8.25 Drug Central
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 8.27 8.27 8.27 Drug Central
α2A ADA2A Human Adrenoceptors A pKi 8.29 8.29 8.29 Drug Central
α2B ADA2B Human Adrenoceptors A pKi 8.3 8.3 8.3 Drug Central
α2C ADA2C Human Adrenoceptors A pKi 8.26 8.26 8.26 Drug Central
β3 ADRB3 Human Adrenoceptors A pKi 8.31 8.31 8.31 Drug Central
D1 DRD1 Human Dopamine A pKi 8.3 8.3 8.3 Drug Central
D3 DRD3 Human Dopamine A pKi 8.3 8.3 8.3 Drug Central
μ OPRM Human Opioid A pKi 8.28 8.28 8.28 Drug Central
NK2 NK2R Human Tachykinin A pKi 8.3 8.3 8.3 Drug Central
A3 AA3R Human Adenosine A pKi 8.28 8.28 8.28 Drug Central
κ OPRK Human Opioid A pKi 8.28 8.28 8.28 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK2 NK2R Human Tachykinin A pIC50 4.58 4.58 4.58 ChEMBL
α2B ADA2B Human Adrenoceptors A pIC50 4.63 4.63 4.63 ChEMBL
α2C ADA2C Human Adrenoceptors A pIC50 4.62 4.62 4.62 ChEMBL
β3 ADRB3 Human Adrenoceptors A pIC50 4.77 4.77 4.77 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pIC50 4.75 4.75 4.75 ChEMBL
α2A ADA2A Human Adrenoceptors A pIC50 4.74 4.74 4.74 ChEMBL
D1 DRD1 Human Dopamine A pIC50 4.69 4.69 4.69 ChEMBL
D3 DRD3 Human Dopamine A pIC50 4.54 4.54 4.54 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pIC50 5.05 5.05 5.05 ChEMBL
A3 AA3R Human Adenosine A pIC50 4.95 4.95 4.95 ChEMBL
κ OPRK Human Opioid A pIC50 4.81 4.81 4.81 ChEMBL
μ OPRM Human Opioid A pIC50 4.85 4.85 4.85 ChEMBL