General Information of the Compound
| Compound ID |
CP0510305
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[[4-chloro-6-[hydroxy-(3-methylimidazol-4-yl)-pyridin-4-ylmethyl]-3-phenylquinolin-2-yl]-methylamino]ethanol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H26ClN5O2
|
||||||||||||||||||
| Molecular Weight |
500.002
|
||||||||||||||||||
| Canonical SMILES |
CN(CCO)c1nc2ccc(cc2c(Cl)c1-c1ccccc1)C(O)(c1cncn1C)c1ccncc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H26ClN5O2/c1-33(14-15-35)27-25(19-6-4-3-5-7-19)26(29)22-16-21(8-9-23(22)32-27)28(36,20-10-12-30-13-11-20)24-17-31-18-34(24)2/h3-13,16-18,35-36H,14-15H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZZVSEQGRJBFYNM-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