General Information of the Compound
| Compound ID |
CP0910212
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-{2-(3-chlorophenyl)-4-[3-oxospiro[2,3-dihydro-1H-indene-1,4'-(hexahydropyridine)]-1-yl]butyl}-5-phenyl-(5R)-tetrahydro-1H-2,4-imidazoledione
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C32H32ClN3O3
|
||||||||||||||||||
| Molecular Weight |
542.079
|
||||||||||||||||||
| Canonical SMILES |
O=C1CC2(CCN(CCC(CN3C(=O)N[C@H](c4ccccc4)C3=O)c3cccc(Cl)c3)CC2)c2ccccc21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C32H32ClN3O3/c33-25-10-6-9-23(19-25)24(21-36-30(38)29(34-31(36)39)22-7-2-1-3-8-22)13-16-35-17-14-32(15-18-35)20-28(37)26-11-4-5-12-27(26)32/h1-12,19,24,29H,13-18,20-21H2,(H,34,39)/t24?,29-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
MGIDXWHXFOXZPR-HOINCLMKSA-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