General Information of the Compound
| Compound ID |
CP0542412
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(3-(4-chlorophenethyl)-1,2,4-oxadiazol-5-yl)-4-(4-methylpiperazin-1-yl)-1H-indole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H24ClN5O
|
||||||||||||||||||
| Molecular Weight |
421.932
|
||||||||||||||||||
| Canonical SMILES |
CN1CCN(CC1)c1cccc2[nH]c(cc12)-c1nc(CCc2ccc(Cl)cc2)no1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H24ClN5O/c1-28-11-13-29(14-12-28)21-4-2-3-19-18(21)15-20(25-19)23-26-22(27-30-23)10-7-16-5-8-17(24)9-6-16/h2-6,8-9,15,25H,7,10-14H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
JXVLSCXVNQXJPE-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