General Information of the Compound
| Compound ID |
CP0806770
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
cyclopentyl 6-methyl-4-(4-(methylsulfonyl)phenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H22N2O5S
|
||||||||||||||||||
| Molecular Weight |
378.45
|
||||||||||||||||||
| Canonical SMILES |
CC1=C(C(=O)OC2CCCC2)C(c2ccc(S(C)(=O)=O)cc2)NC(=O)N1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H22N2O5S/c1-11-15(17(21)25-13-5-3-4-6-13)16(20-18(22)19-11)12-7-9-14(10-8-12)26(2,23)24/h7-10,13,16H,3-6H2,1-2H3,(H2,19,20,22)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UQDOXYQRUIGLGX-UHFFFAOYSA-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