SILDENAFIL


SMILES CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N4CCN(C)CC4)ccc3OCC)nc12
InChIKey BNRNXUUZRGQAQC-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 474.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1B ADA1B Rat Adrenoceptors A pKi 6.09 6.09 6.09 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.7 6.78 6.85 ChEMBL
A1 AA1R Human Adenosine A pKi 6.06 6.06 6.06 ChEMBL
A1 AA1R Human Adenosine A pKi 8.22 8.22 8.22 Drug Central
A2A AA2AR Human Adenosine A pKi 8.17 8.17 8.17 Drug Central
α1B ADA1B Rat Adrenoceptors A pKi 8.22 8.22 8.22 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1B ADA1B Rat Adrenoceptors A pIC50 5.84 5.84 5.84 ChEMBL
A2A AA2AR Human Adenosine A pIC50 6.6 6.6 6.6 ChEMBL
A1 AA1R Human Adenosine A pIC50 5.83 5.83 5.83 ChEMBL