General Information of the Compound
| Compound ID |
CP0573680
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(cyclobutylmethyl)-5-[(4-methylbenzoyl)amino]pyrazole-3-carboxylic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H19N3O3
|
||||||||||||||||||
| Molecular Weight |
313.357
|
||||||||||||||||||
| Canonical SMILES |
Cc1ccc(cc1)C(=O)Nc1cc(nn1CC1CCC1)C(O)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H19N3O3/c1-11-5-7-13(8-6-11)16(21)18-15-9-14(17(22)23)19-20(15)10-12-3-2-4-12/h5-9,12H,2-4,10H2,1H3,(H,18,21)(H,22,23)
Show/Hide
|
||||||||||||||||||
| InChIKey |
KKBZBJGKDDIOHU-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