|
ADME properties
|
2a
|
2b
|
2c
|
2d
|
2e
|
2f
|
2g
|
2h
|
|---|
|
Absorption
|
|
WS (log mol/L)
|
− 3.147
|
− 3.599
|
− 3.644
|
− 3.8
|
− 3.901
|
− 3.538
|
− 3.742
|
− 4.122
|
|
IS (% abs)
|
95.067
|
92.136
|
93.112
|
92.486
|
94.048
|
94.329
|
91.609
|
95.929
|
|
SP (logKp)
|
− 2.46
|
− 2.865
|
− 2.826
|
− 2.837
|
− 2.943
|
− 2.508
|
− 2.908
|
− 2.61
|
|
Distribution
|
|
BBBP (logBB)
|
0.055
|
− 0.545
|
− 0.549
|
− 0.574
|
− 0.726
|
0.389
|
− 0.518
|
0.291
|
|
CNSP (logPS)
|
− 2.215
|
− 2.407
|
− 2.905
|
− 2.915
|
− 2.973
|
− 2.768
|
− 2.864
|
− 2.772
|
|
Metabolism
|
|
CYP3A4 inhibitor
|
Yes
|
No
|
No
|
No
|
No
|
No
|
No
|
No
|
|
Excretion
|
|
TC (log mL/min/kg)
|
0.297
|
0.248
|
0.192
|
0.07
|
0.273
|
0.254
|
0.278
|
0.278
|
- WS water solubility, IS intestinal solubility (% abs absorption), SP skin permeability, BBBP blood brain barrier permeability, CNSP Central Nervous System permeability, TC total clearance
