General Information of the Compound
| Compound ID |
CP0574337
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(1-cyclobutylpyrazol-4-yl)-2-fluoro-3-(1-methylpyrazol-4-yl)benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H18FN5O
|
||||||||||||||||||
| Molecular Weight |
339.374
|
||||||||||||||||||
| Canonical SMILES |
Cn1cc(cn1)-c1cccc(C(=O)Nc2cnn(c2)C2CCC2)c1F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H18FN5O/c1-23-10-12(8-20-23)15-6-3-7-16(17(15)19)18(25)22-13-9-21-24(11-13)14-4-2-5-14/h3,6-11,14H,2,4-5H2,1H3,(H,22,25)
Show/Hide
|
||||||||||||||||||
| InChIKey |
XBTMBRMHZRXXHS-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 | |||||||||||||||||||
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