General Information of the Compound
| Compound ID |
CP0273542
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-chloro-2-[(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)methyl]-1-benzofuran-7-carboxylic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H11ClN4O4
|
||||||||||||||||||
| Molecular Weight |
370.752
|
||||||||||||||||||
| Canonical SMILES |
OC(=O)c1cc(Cl)cc2cc(CNC(=O)c3cnn4cccnc34)oc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H11ClN4O4/c18-10-4-9-5-11(26-14(9)12(6-10)17(24)25)7-20-16(23)13-8-21-22-3-1-2-19-15(13)22/h1-6,8H,7H2,(H,20,23)(H,24,25)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ITYJDGPPMPQLSS-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