General Information of the Compound
| Compound ID |
CP0943624
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(E)-3-[4-(Acetyl-methyl-amino)-phenyl]-N-({[3-(3-bromo-2-methyl-imidazo[1,2-a]pyridin-8-yloxymethyl)-2,4-dichloro-phenyl]-methyl-carbamoyl}-methyl)-acrylamide hydrochloride
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H29BrCl3N5O4
|
||||||||||||||||||
| Molecular Weight |
709.856
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)N(C)c1ccc(/C=C/C(=O)NCC(=O)N(C)c2ccc(Cl)c(COc3cccn4c(Br)c(C)nc34)c2Cl)cc1.Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H28BrCl2N5O4.ClH/c1-18-29(31)38-15-5-6-25(30(38)35-18)42-17-22-23(32)12-13-24(28(22)33)37(4)27(41)16-34-26(40)14-9-20-7-10-21(11-8-20)36(3)19(2)39;/h5-15H,16-17H2,1-4H3,(H,34,40);1H/b14-9+;
Show/Hide
|
||||||||||||||||||
| InChIKey |
FKQBPGYDZNKKET-KYIGKLDSSA-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