General Information of the Compound
| Compound ID |
CP0394574
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(2-fluoro-benzyl)-3-(3-methoxy-phenyl)-8-[4-(2-methyl-imidazol-1-yl)-benzyl]-1,3,8-triaza-spiro[4.5]decane-2,4-dione
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C32H32FN5O3
|
||||||||||||||||||
| Molecular Weight |
553.638
|
||||||||||||||||||
| Canonical SMILES |
COc1cccc(c1)N1C(=O)N(Cc2ccccc2F)C2(CCN(Cc3ccc(cc3)-n3ccnc3C)CC2)C1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C32H32FN5O3/c1-23-34-16-19-36(23)26-12-10-24(11-13-26)21-35-17-14-32(15-18-35)30(39)38(27-7-5-8-28(20-27)41-2)31(40)37(32)22-25-6-3-4-9-29(25)33/h3-13,16,19-20H,14-15,17-18,21-22H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
GODOQGRZKLKQSO-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