General Information of the Compound
| Compound ID |
CP0482674
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(3-ethynylphenyl)-2-phenylquinazolin-4-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H15N3
|
||||||||||||||||||
| Molecular Weight |
321.383
|
||||||||||||||||||
| Canonical SMILES |
C#Cc1cccc(Nc2nc(nc3ccccc23)-c2ccccc2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H15N3/c1-2-16-9-8-12-18(15-16)23-22-19-13-6-7-14-20(19)24-21(25-22)17-10-4-3-5-11-17/h1,3-15H,(H,23,24,25)
Show/Hide
|
||||||||||||||||||
| InChIKey |
FLGLOQCIUMFVPN-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