General Information of the Compound
| Compound ID |
CP0553560
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(3S)-3-amino-3-(6-tert-butyl-1H-benzimidazol-2-yl)-2,2-dimethylpropanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H24N4O
|
||||||||||||||||||
| Molecular Weight |
288.395
|
||||||||||||||||||
| Canonical SMILES |
CC(C)(C)c1ccc2[nH]c(nc2c1)[C@@H](N)C(C)(C)C(N)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H24N4O/c1-15(2,3)9-6-7-10-11(8-9)20-13(19-10)12(17)16(4,5)14(18)21/h6-8,12H,17H2,1-5H3,(H2,18,21)(H,19,20)/t12-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
LRVZVLLBGQIXOZ-GFCCVEGCSA-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