General Information of the Compound
| Compound ID |
CP0298458
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-oxo-N-(3-propan-2-yl-1,2-oxazol-5-yl)-2,3,4,5-tetrahydro-[1,4]diazepino[1,2-a]indole-8-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H20N4O3
|
||||||||||||||||||
| Molecular Weight |
352.394
|
||||||||||||||||||
| Canonical SMILES |
CC(C)c1cc(NC(=O)c2ccc3cc4C(=O)NCCCn4c3c2)on1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H20N4O3/c1-11(2)14-10-17(26-22-14)21-18(24)13-5-4-12-8-16-19(25)20-6-3-7-23(16)15(12)9-13/h4-5,8-11H,3,6-7H2,1-2H3,(H,20,25)(H,21,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
JBOKTWNEIMBJNQ-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