General Information of the Compound
| Compound ID |
CP0952991
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(S)-1-(4-(4-chlorophenyl)-1H-imidazol-2-yl)-4-methylpentan-2-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H20ClN3
|
||||||||||||||||||
| Molecular Weight |
277.799
|
||||||||||||||||||
| Canonical SMILES |
CC(C)C[C@H](N)Cc1nc(-c2ccc(Cl)cc2)c[nH]1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H20ClN3/c1-10(2)7-13(17)8-15-18-9-14(19-15)11-3-5-12(16)6-4-11/h3-6,9-10,13H,7-8,17H2,1-2H3,(H,18,19)/t13-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
KWHWTZDVUUPSGW-ZDUSSCGKSA-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
Protein ID: PT02752, Sodium channel protein type 10 subunit alpha
Protein ID: PT01105, Sodium channel protein type 5 subunit alpha