General Information of the Compound
| Compound ID |
CP0402074
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(E)-N-[4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-4-methylpent-2-enamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H18N4O2S2
|
||||||||||||||||||
| Molecular Weight |
350.469
|
||||||||||||||||||
| Canonical SMILES |
CC(C)\C=C\C(=O)Nc1nc(cs1)-c1sc(NC(C)=O)nc1C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H18N4O2S2/c1-8(2)5-6-12(21)19-14-18-11(7-22-14)13-9(3)16-15(23-13)17-10(4)20/h5-8H,1-4H3,(H,16,17,20)(H,18,19,21)/b6-5+
Show/Hide
|
||||||||||||||||||
| InChIKey |
BHNLPHFGIMIKBX-AATRIKPKSA-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