General Information of the Compound
| Compound ID |
CP0905542
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(R)-N-((2-((N-hydroxyformamido)methyl)heptanamido)methyl)-6-phenylpyrazine-2-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H27N5O4
|
||||||||||||||||||
| Molecular Weight |
413.478
|
||||||||||||||||||
| Canonical SMILES |
CCCCC[C@H](CN(O)C=O)C(=O)NCNC(=O)c1cncc(-c2ccccc2)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H27N5O4/c1-2-3-5-10-17(13-26(30)15-27)20(28)23-14-24-21(29)19-12-22-11-18(25-19)16-8-6-4-7-9-16/h4,6-9,11-12,15,17,30H,2-3,5,10,13-14H2,1H3,(H,23,28)(H,24,29)/t17-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
AJLXZLYDPGDGTG-QGZVFWFLSA-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
Protein ID: PT04609, Tolloid-like protein 1
Protein ID: PT06770, Tolloid-like protein 2