KinasePro

Kinase Chemistry – Just a year and a half behind the times.

Rule of 5

This dataset describes the physicochemical descriptors of clinical stage kinase inhibitors, and is inpired by the renowned: rule of 5.  There’s a legend for the images: here.

Without using Thomson / SciFinder I can’t tell you how laborious it is to compile and update this type of list. You are welcome to use these files however you like under the simple agreement that when you share and / or use this data in its current or any modified form you will cite KinasePro (https://kinasepro.wordpress.com) as your source.

Thanks, and as always: email me any errors / omissions you find

Molecular Weight

Molecular Refractivity

Total Polar Surface Area

Rotatable Bonds

Hydrogen Bond Donors

Hydrogen Bond Acceptors

calculated Log P

calculated Log D