General Information of the Compound
| Compound ID |
CP0845546
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(R)-3-(2',2'-Dimethyl-dodecanoyl)amino-caprolactam
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H38N2O2
|
||||||||||||||||||
| Molecular Weight |
338.536
|
||||||||||||||||||
| Canonical SMILES |
CCCCCCCCCCC(C)(C)C(=O)N[C@@H]1CCCCNC1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H38N2O2/c1-4-5-6-7-8-9-10-12-15-20(2,3)19(24)22-17-14-11-13-16-21-18(17)23/h17H,4-16H2,1-3H3,(H,21,23)(H,22,24)/t17-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZFZLJMLRYQQQJX-QGZVFWFLSA-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