General Information of the Compound
| Compound ID |
CP0372440
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(S)-N-(2'-oxo-1,1',2',3-tetrahydrospiro[indene-2,3'-pyrrolo[2,3-b]pyridine]-5-yl)-2-(2-oxo-3-(pyrimidin-4-yl)-2,3-dihydro-1H-benzo[d]imidazol-1-yl)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H21N7O3
|
||||||||||||||||||
| Molecular Weight |
503.522
|
||||||||||||||||||
| Canonical SMILES |
O=C(Cn1c2ccccc2n(-c2ccncn2)c1=O)Nc1ccc2C[C@@]3(Cc2c1)C(=O)Nc1ncccc31
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H21N7O3/c36-24(15-34-21-5-1-2-6-22(21)35(27(34)38)23-9-11-29-16-31-23)32-19-8-7-17-13-28(14-18(17)12-19)20-4-3-10-30-25(20)33-26(28)37/h1-12,16H,13-15H2,(H,32,36)(H,30,33,37)/t28-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
RIWBPOKEPFFMJB-NDEPHWFRSA-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