General Information of the Compound
| Compound ID |
CP0387784
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2S)-2-[[2-(2-methoxyphenyl)-1-quinolin-4-ylimidazole-4-carbonyl]amino]-4-methylpentanoic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H26N4O4
|
||||||||||||||||||
| Molecular Weight |
458.518
|
||||||||||||||||||
| Canonical SMILES |
COc1ccccc1-c1nc(cn1-c1ccnc2ccccc12)C(=O)N[C@@H](CC(C)C)C(O)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H26N4O4/c1-16(2)14-20(26(32)33)29-25(31)21-15-30(22-12-13-27-19-10-6-4-8-17(19)22)24(28-21)18-9-5-7-11-23(18)34-3/h4-13,15-16,20H,14H2,1-3H3,(H,29,31)(H,32,33)/t20-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZAOHUDBTLMWIMN-FQEVSTJZSA-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