General Information of the Compound
| Compound ID |
CP0492198
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(4Z,7R)-4-benzylidene-7-methyl-15-oxa-2,5,8-triazatricyclo[8.5.0.03,8]pentadeca-1(10),2,11,13-tetraene-6,9-dione
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H15N3O3
|
||||||||||||||||||
| Molecular Weight |
333.347
|
||||||||||||||||||
| Canonical SMILES |
C[C@@H]1C(=O)N\C(=C/c2ccccc2)c2nc3OC=CC=Cc3c(=O)n12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H15N3O3/c1-12-17(23)20-15(11-13-7-3-2-4-8-13)16-21-18-14(19(24)22(12)16)9-5-6-10-25-18/h2-12H,1H3,(H,20,23)/b15-11-/t12-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
CJYUEDLQBHFMDJ-QJMZJAKPSA-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