General Information of the Compound
| Compound ID |
CP0383334
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[6-(1H-benzimidazol-2-yl)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H20N4OS
|
||||||||||||||||||
| Molecular Weight |
376.485
|
||||||||||||||||||
| Canonical SMILES |
O=C(Nc1nc2ccc(cc2s1)-c1nc2ccccc2[nH]1)C1CCCCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H20N4OS/c26-20(13-6-2-1-3-7-13)25-21-24-17-11-10-14(12-18(17)27-21)19-22-15-8-4-5-9-16(15)23-19/h4-5,8-13H,1-3,6-7H2,(H,22,23)(H,24,25,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
DUQOPQWEOVRBOE-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