General Information of the Compound
| Compound ID |
CP0903088
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(diaminomethylene)-5-methyl-2-phenyl-1H-imidazole-4-carboxamide methanesulfonate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C13H17N5O4S
|
||||||||||||||||||
| Molecular Weight |
339.377
|
||||||||||||||||||
| Canonical SMILES |
CS(=O)(=O)O.Cc1[nH]c(-c2ccccc2)nc1C(=O)N=C(N)N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C12H13N5O.CH4O3S/c1-7-9(11(18)17-12(13)14)16-10(15-7)8-5-3-2-4-6-8;1-5(2,3)4/h2-6H,1H3,(H,15,16)(H4,13,14,17,18);1H3,(H,2,3,4)
Show/Hide
|
||||||||||||||||||
| InChIKey |
LVVBKUZOTACNIK-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