General Information of the Compound
| Compound ID |
CP0537214
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US8912224, 124
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H23N3O4S3
|
||||||||||||||||||
| Molecular Weight |
549.699
|
||||||||||||||||||
| Canonical SMILES |
Cc1nc2ccc(cc2s1)S(=O)(=O)NCc1cnc(Oc2ccc3OC(CCc3c2)c2ccccc2)s1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H23N3O4S3/c1-17-30-23-10-9-22(14-26(23)35-17)37(31,32)29-16-21-15-28-27(36-21)33-20-8-12-25-19(13-20)7-11-24(34-25)18-5-3-2-4-6-18/h2-6,8-10,12-15,24,29H,7,11,16H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
KDSSBHWHPLJSBZ-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