General Information of the Compound
| Compound ID |
CP0558227
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(1R,7S)-1,3,10,10-tetramethyl-4-(4-methylphenyl)-3,4-diazatricyclo[5.2.1.02,6]dec-2(6)-en-5-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H24N2O
|
||||||||||||||||||
| Molecular Weight |
296.414
|
||||||||||||||||||
| Canonical SMILES |
Cc1ccc(cc1)-n1n(C)c2c([C@H]3CC[C@]2(C)C3(C)C)c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H24N2O/c1-12-6-8-13(9-7-12)21-17(22)15-14-10-11-19(4,18(14,2)3)16(15)20(21)5/h6-9,14H,10-11H2,1-5H3/t14-,19+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
QFSDKHPEZOHTHZ-KUHUBIRLSA-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