General Information of the Compound
| Compound ID |
CP0969092
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(S)-3-(5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl)-N-(2,5-dioxopyrrolidin-3-yl)propanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H16F3N3O3
|
||||||||||||||||||
| Molecular Weight |
415.371
|
||||||||||||||||||
| Canonical SMILES |
O=C1C[C@H](NC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3c(F)cc(F)cc23)C(=O)N1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H16F3N3O3/c22-11-3-1-10(2-4-11)19-13(14-7-12(23)8-15(24)20(14)27-19)5-6-17(28)25-16-9-18(29)26-21(16)30/h1-4,7-8,16,27H,5-6,9H2,(H,25,28)(H,26,29,30)/t16-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
QAWRGWPULAFBNW-INIZCTEOSA-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 | |||||||||||||||||||
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