General Information of the Compound
| Compound ID |
CP0905159
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-Aziridin-1-yl-3-hydroxymethyl-6-methyl-4,7-dioxo-4,7-dihydro-1H-indole-2-carboxylic acid ethyl ester
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H16N2O5
|
||||||||||||||||||
| Molecular Weight |
304.302
|
||||||||||||||||||
| Canonical SMILES |
CCOC(=O)c1[nH]c2c(c1CO)C(=O)C(N1CC1)=C(C)C2=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H16N2O5/c1-3-22-15(21)10-8(6-18)9-11(16-10)13(19)7(2)12(14(9)20)17-4-5-17/h16,18H,3-6H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
CPYOKICVVBBAPZ-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