General Information of the Compound
| Compound ID |
CP0573851
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US8993565, 147
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H18F2N4O3
|
||||||||||||||||||
| Molecular Weight |
376.363
|
||||||||||||||||||
| Canonical SMILES |
Fc1cc2CCN(C(=O)Cc3nc(cc(=O)[nH]3)N3CCOCC3)c2cc1F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H18F2N4O3/c19-12-7-11-1-2-24(14(11)8-13(12)20)18(26)9-15-21-16(10-17(25)22-15)23-3-5-27-6-4-23/h7-8,10H,1-6,9H2,(H,21,22,25)
Show/Hide
|
||||||||||||||||||
| InChIKey |
KKEAGYTZUKDUEG-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