General Information of the Compound
| Compound ID |
CP0499534
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-chloro-3-[(9-oxofluorene-1-carbonyl)amino]benzoic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H12ClNO4
|
||||||||||||||||||
| Molecular Weight |
377.783
|
||||||||||||||||||
| Canonical SMILES |
OC(=O)c1cccc(NC(=O)c2cccc3-c4ccccc4C(=O)c23)c1Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H12ClNO4/c22-18-15(21(26)27)9-4-10-16(18)23-20(25)14-8-3-7-12-11-5-1-2-6-13(11)19(24)17(12)14/h1-10H,(H,23,25)(H,26,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
KTJZSAPPUPWDKY-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