General Information of the Compound
| Compound ID |
CP0536789
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(6-Chloro-9H-beta-carbolin-8-yl)-3-methyl-urea
Show/Hide
|
||||||||||||||||||
| Formula |
C13H11ClN4O
|
||||||||||||||||||
| Molecular Weight |
274.711
|
||||||||||||||||||
| Canonical SMILES |
CNC(=O)Nc1cc(Cl)cc2c1nc1c[nH]ccc21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C13H11ClN4O/c1-15-13(19)18-10-5-7(14)4-9-8-2-3-16-6-11(8)17-12(9)10/h2-6,16H,1H3,(H2,15,18,19)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CZZJHJXVGWDXFO-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 | |||||||||||||||||||
| 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