General Information of the Compound
| Compound ID |
CP0945631
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(E)-4-(3-Triphenylphosphoniumpropyloxy)stilbene Iodide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C35H32IOP
|
||||||||||||||||||
| Molecular Weight |
626.518
|
||||||||||||||||||
| Canonical SMILES |
C(=C/c1ccc(OCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1)\c1ccccc1.[I-]
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C35H32OP.HI/c1-5-14-30(15-6-1)22-23-31-24-26-32(27-25-31)36-28-13-29-37(33-16-7-2-8-17-33,34-18-9-3-10-19-34)35-20-11-4-12-21-35;/h1-12,14-27H,13,28-29H2;1H/q+1;/p-1/b23-22+;
Show/Hide
|
||||||||||||||||||
| InChIKey |
TVAJSTLSCVCRRZ-PGCQSHBKSA-M
|
||||||||||||||||||
| 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