General Information of the Compound
| Compound ID |
CP0965302
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(3R,4R)-3-(6-chloro-3H-imidazo[4,5-b]pyridin-2-yl)-4-(2,6-difluoro-4-methoxyphenyl)pyrrolidin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H13ClF2N4O2
|
||||||||||||||||||
| Molecular Weight |
378.766
|
||||||||||||||||||
| Canonical SMILES |
COc1cc(F)c([C@@H]2CNC(=O)[C@H]2c2nc3cc(Cl)cnc3[nH]2)c(F)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H13ClF2N4O2/c1-26-8-3-10(19)13(11(20)4-8)9-6-22-17(25)14(9)16-23-12-2-7(18)5-21-15(12)24-16/h2-5,9,14H,6H2,1H3,(H,22,25)(H,21,23,24)/t9-,14+/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZIHVZUJKJMKXIT-LKFCYVNXSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound