General Information of the Compound
| Compound ID |
CP0899372
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-Chloro-8-methyl-2-(3-phenyl-1H-pyrazol-4-yl)-2,3-dihydroquinazolin-4(1H)-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H15ClN4O
|
||||||||||||||||||
| Molecular Weight |
338.798
|
||||||||||||||||||
| Canonical SMILES |
Cc1cc(Cl)cc2c1NC(c1c[nH]nc1-c1ccccc1)NC2=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H15ClN4O/c1-10-7-12(19)8-13-15(10)21-17(22-18(13)24)14-9-20-23-16(14)11-5-3-2-4-6-11/h2-9,17,21H,1H3,(H,20,23)(H,22,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
DEMBTDVKDCOCSF-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