General Information of the Compound
| Compound ID |
CP0468889
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
methyl 3-[[3,3-diphenylpropyl(2-morpholin-4-ylethyl)carbamoyl]amino]thiophene-2-carboxylate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H33N3O4S
|
||||||||||||||||||
| Molecular Weight |
507.656
|
||||||||||||||||||
| Canonical SMILES |
COC(=O)c1sccc1NC(=O)N(CCC(c1ccccc1)c1ccccc1)CCN1CCOCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H33N3O4S/c1-34-27(32)26-25(13-21-36-26)29-28(33)31(16-15-30-17-19-35-20-18-30)14-12-24(22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-11,13,21,24H,12,14-20H2,1H3,(H,29,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SOPDDXGZGRDZAS-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