General Information of the Compound
| Compound ID |
CP0508802
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(2,3-dimethylindazol-5-yl)-4-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methoxy]pyridin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H15F3N4O2S
|
||||||||||||||||||
| Molecular Weight |
420.416
|
||||||||||||||||||
| Canonical SMILES |
Cc1n(C)nc2ccc(cc12)-n1ccc(OCc2nc(cs2)C(F)(F)F)cc1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H15F3N4O2S/c1-11-14-7-12(3-4-15(14)24-25(11)2)26-6-5-13(8-18(26)27)28-9-17-23-16(10-29-17)19(20,21)22/h3-8,10H,9H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
XMNXODJNMMIWIF-UHFFFAOYSA-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 | |||||||||||||||||||
| 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
Protein ID: PT01388, Melanin-concentrating hormone receptor 1
Protein ID: PT01027, Melanin-concentrating hormone receptor 1