What the doctor ordered
One of my "hobbies" is to investigate the molecular structure and physicochemical properties of drugs that are prescribed by my doctor. (When you start doing this you know you've been in the field too long).
I've been doing too much computer work lately so I have a sore back. My doctor prescribed cyclobenzaprine (Flexeril) as a muscle relaxant. Here's the 2D molecular structure:
Cyclobenzaprine
I was curious to know if this drug followed Lipinski's rules for "drug-like" compounds. Here's some data:
Molecular weight: 275
H-bond donors: 0
H-bond acceptors: 1
Rotatable bonds: 3
LogP: 4.9
These values do indeed fall within the range of Lipinski's rules. Also, the drug really works - my back feels much better now.
I've been doing too much computer work lately so I have a sore back. My doctor prescribed cyclobenzaprine (Flexeril) as a muscle relaxant. Here's the 2D molecular structure:
Cyclobenzaprine
I was curious to know if this drug followed Lipinski's rules for "drug-like" compounds. Here's some data:
Molecular weight: 275
H-bond donors: 0
H-bond acceptors: 1
Rotatable bonds: 3
LogP: 4.9
These values do indeed fall within the range of Lipinski's rules. Also, the drug really works - my back feels much better now.
posted by CADDBLOG at 3:40 PM
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