General Information of the Compound
Compound ID |
CP0670149
|
||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Compound Name |
(R)-3-(5-fluoro-1H-indol-3-yl)pyrrolidine-2,5-dione
Show/Hide
|
||||||||||||||||||
Structure |
|
||||||||||||||||||
Formula |
C12H9FN2O2
|
||||||||||||||||||
Molecular Weight |
232.214
|
||||||||||||||||||
Canonical SMILES |
O=C1C[C@H](c2c[nH]c3ccc(F)cc23)C(=O)N1
Show/Hide
|
||||||||||||||||||
InChI |
InChI=1S/C12H9FN2O2/c13-6-1-2-10-7(3-6)9(5-14-10)8-4-11(16)15-12(8)17/h1-3,5,8,14H,4H2,(H,15,16,17)/t8-/m1/s1
Show/Hide
|
||||||||||||||||||
InChIKey |
MXKLDYKORJEOPR-MRVPVSSYSA-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 |