General Information of the Compound
| Compound ID |
CP0389686
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[5-[5-(2-methyl-1-oxo-3H-isoindol-5-yl)thiophen-2-yl]pyridin-3-yl]-5-(1,2-oxazol-5-yl)thiophene-2-sulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H18N4O4S3
|
||||||||||||||||||
| Molecular Weight |
534.644
|
||||||||||||||||||
| Canonical SMILES |
CN1Cc2cc(ccc2C1=O)-c1ccc(s1)-c1cncc(NS(=O)(=O)c2ccc(s2)-c2ccno2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H18N4O4S3/c1-29-14-17-10-15(2-3-19(17)25(29)30)21-4-5-22(34-21)16-11-18(13-26-12-16)28-36(31,32)24-7-6-23(35-24)20-8-9-27-33-20/h2-13,28H,14H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
JCCVLAGTNBSUSM-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