General Information of the Compound
| Compound ID |
CP0374259
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(2-fluoropyridin-3-yl)-2-(3-(6-hydroxynaphthalen-2-yl)propanamido)cyclohex-1-enecarboxylic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H23FN2O4
|
||||||||||||||||||
| Molecular Weight |
434.467
|
||||||||||||||||||
| Canonical SMILES |
OC(=O)C1=C(CCC(C1)c1cccnc1F)NC(=O)CCc1ccc2cc(O)ccc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H23FN2O4/c26-24-20(2-1-11-27-24)18-7-9-22(21(14-18)25(31)32)28-23(30)10-4-15-3-5-17-13-19(29)8-6-16(17)12-15/h1-3,5-6,8,11-13,18,29H,4,7,9-10,14H2,(H,28,30)(H,31,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
QQFZIJVFVZPNPI-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