General Information of the Compound
| Compound ID |
CP0576279
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[4-(difluoromethyl)-7-methyl-6-(4-morpholin-4-ylphenyl)indazol-2-yl]-2-[(6R)-6-fluoro-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-1-yl]-N-(1,3-thiazol-2-yl)acetamide
Show/Hide
|
||||||||||||||||||
| Formula |
C30H28F3N7O2S
|
||||||||||||||||||
| Molecular Weight |
607.662
|
||||||||||||||||||
| Canonical SMILES |
Cc1c(cc(C(F)F)c2cn(nc12)C(C(=O)Nc1nccs1)c1ncn2C[C@H](F)Cc12)-c1ccc(cc1)N1CCOCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H28F3N7O2S/c1-17-21(18-2-4-20(5-3-18)38-7-9-42-10-8-38)13-22(28(32)33)23-15-40(37-25(17)23)27(29(41)36-30-34-6-11-43-30)26-24-12-19(31)14-39(24)16-35-26/h2-6,11,13,15-16,19,27-28H,7-10,12,14H2,1H3,(H,34,36,41)/t19-,27?/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
KSCFIHWKOFXWCE-FOEZPWHWSA-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 | |||||||||||||||||||
| ChEMBL 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