General Information of the Compound
| Compound ID |
CP0571260
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-cyclopropyl-1-[3-[2-fluoro-3-(piperidine-1-carbonyl)phenyl]phenyl]pyrazole-4-carboxylic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H24FN3O3
|
||||||||||||||||||
| Molecular Weight |
433.483
|
||||||||||||||||||
| Canonical SMILES |
OC(=O)c1cnn(c1C1CC1)-c1cccc(c1)-c1cccc(C(=O)N2CCCCC2)c1F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H24FN3O3/c26-22-19(8-5-9-20(22)24(30)28-12-2-1-3-13-28)17-6-4-7-18(14-17)29-23(16-10-11-16)21(15-27-29)25(31)32/h4-9,14-16H,1-3,10-13H2,(H,31,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
POXZWUFGBAMZNF-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