General Information of the Compound
| Compound ID |
CP0449043
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(2-fluoro-benzyl)-8-(4-imidazol-1-yl-benzyl)-3-phenyl-1,3,8-triaza-spiro[4.5]decane-2,4-dione
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H28FN5O2
|
||||||||||||||||||
| Molecular Weight |
509.585
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccccc1CN1C(=O)N(C(=O)C11CCN(Cc2ccc(cc2)-n2ccnc2)CC1)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H28FN5O2/c31-27-9-5-4-6-24(27)21-35-29(38)36(26-7-2-1-3-8-26)28(37)30(35)14-17-33(18-15-30)20-23-10-12-25(13-11-23)34-19-16-32-22-34/h1-13,16,19,22H,14-15,17-18,20-21H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
GUMYTXPIUDRCCP-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