General Information of the Compound
| Compound ID |
CP0849022
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(2-thioxoimidazolidine-1-carbothioyl)-benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C11H11N3OS2
|
||||||||||||||||||
| Molecular Weight |
265.363
|
||||||||||||||||||
| Canonical SMILES |
O=C(NC(=S)N1CCNC1=S)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C11H11N3OS2/c15-9(8-4-2-1-3-5-8)13-11(17)14-7-6-12-10(14)16/h1-5H,6-7H2,(H,12,16)(H,13,15,17)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CNUVXKFALYNKND-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