General Information of the Compound
| Compound ID |
CP0498055
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1H-imidazol-5-ylmethyl N-[3-(1H-indol-3-yl)-1-oxo-1-(2-phenylethylamino)propan-2-yl]carbamate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H25N5O3
|
||||||||||||||||||
| Molecular Weight |
431.496
|
||||||||||||||||||
| Canonical SMILES |
O=C(NC(Cc1c[nH]c2ccccc12)C(=O)NCCc1ccccc1)OCc1cnc[nH]1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H25N5O3/c30-23(26-11-10-17-6-2-1-3-7-17)22(29-24(31)32-15-19-14-25-16-28-19)12-18-13-27-21-9-5-4-8-20(18)21/h1-9,13-14,16,22,27H,10-12,15H2,(H,25,28)(H,26,30)(H,29,31)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CJQBVEGZKWGXGA-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