General Information of the Compound
| Compound ID |
CP0952104
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[4-Chloro-2-(1-oxy-pynidime-4-carbonyl)-phenyl]-4-(cis-2,6-dimethyl-morpholin-4-yl)-3-fluorobenzenesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H23ClFN3O5S
|
||||||||||||||||||
| Molecular Weight |
519.982
|
||||||||||||||||||
| Canonical SMILES |
C[C@@H]1CN(c2ccc(S(=O)(=O)Nc3ccc(Cl)cc3C(=O)c3cc[n+]([O-])cc3)cc2F)C[C@H](C)O1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H23ClFN3O5S/c1-15-13-28(14-16(2)34-15)23-6-4-19(12-21(23)26)35(32,33)27-22-5-3-18(25)11-20(22)24(30)17-7-9-29(31)10-8-17/h3-12,15-16,27H,13-14H2,1-2H3/t15-,16+
Show/Hide
|
||||||||||||||||||
| InChIKey |
DIJHIJMLWZYVAL-IYBDPMFKSA-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