General Information of the Compound
| Compound ID |
CP0828632
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(R)-N-(1-(4-(7-Chloro-6-(pyridin-4-yl)quinazolin-2-ylamino)-phenyl)ethyl)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H20ClN5O
|
||||||||||||||||||
| Molecular Weight |
417.9
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)N[C@H](C)c1ccc(Nc2ncc3cc(-c4ccncc4)c(Cl)cc3n2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H20ClN5O/c1-14(27-15(2)30)16-3-5-19(6-4-16)28-23-26-13-18-11-20(17-7-9-25-10-8-17)21(24)12-22(18)29-23/h3-14H,1-2H3,(H,27,30)(H,26,28,29)/t14-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
WZPNFHSAINJZCW-CQSZACIVSA-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