General Information of the Compound
| Compound ID |
CP0339823
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
Biphenyl-3-yl-(8-fluoro-10,11-dihydro-5-oxa-2,4,11-triaza-dibenzo[a,d]cyclohepten-1-yl)-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H17FN4O
|
||||||||||||||||||
| Molecular Weight |
384.414
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc2Oc3ncnc(Nc4cccc(c4)-c4ccccc4)c3NCc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H17FN4O/c24-18-9-10-20-17(11-18)13-25-21-22(26-14-27-23(21)29-20)28-19-8-4-7-16(12-19)15-5-2-1-3-6-15/h1-12,14,25H,13H2,(H,26,27,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
PHNVKBDORVSXOC-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