General Information of the Compound
| Compound ID |
CP0547806
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
7-[(3R)-3-(1-aminocyclopropyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methyl-2-oxoquinoline-3-carboxylic acid
Show/Hide
|
||||||||||||||||||
| Formula |
C21H24FN3O3
|
||||||||||||||||||
| Molecular Weight |
385.439
|
||||||||||||||||||
| Canonical SMILES |
Cc1c(N2CC[C@H](C2)C2(N)CC2)c(F)cc2cc(C(O)=O)c(=O)n(C3CC3)c12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H24FN3O3/c1-11-17-12(8-15(20(27)28)19(26)25(17)14-2-3-14)9-16(22)18(11)24-7-4-13(10-24)21(23)5-6-21/h8-9,13-14H,2-7,10,23H2,1H3,(H,27,28)/t13-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
WJCZHUWTEKABIV-CYBMUJFWSA-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 | |||||||||||||||||||
| 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