General Information of the Compound
| Compound ID |
CP0483803
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-Chloro-4-hydroxy-benzoic acid [1-(4-trifluoromethyl-benzyl)-1H-indol-4-ylmethylene]-hydrazide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H17ClF3N3O2
|
||||||||||||||||||
| Molecular Weight |
471.866
|
||||||||||||||||||
| Canonical SMILES |
Oc1ccc(cc1Cl)C(=O)N\N=C\c1cccc2n(Cc3ccc(cc3)C(F)(F)F)ccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H17ClF3N3O2/c25-20-12-16(6-9-22(20)32)23(33)30-29-13-17-2-1-3-21-19(17)10-11-31(21)14-15-4-7-18(8-5-15)24(26,27)28/h1-13,32H,14H2,(H,30,33)/b29-13+
Show/Hide
|
||||||||||||||||||
| InChIKey |
KAGNGWJJGOZRPM-VFLNYLIXSA-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