General Information of the Compound
| Compound ID |
CP0563070
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US8901315, 176
Show/Hide
|
||||||||||||||||||
| Formula |
C24H36N4O2S
|
||||||||||||||||||
| Molecular Weight |
444.645
|
||||||||||||||||||
| Canonical SMILES |
Cc1nn(C2CCCCC2)c2sc(cc12)C(=O)N[C@H]1CC[C@@H](CC1)N1CCC(O)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H36N4O2S/c1-16-21-15-22(31-24(21)28(26-16)19-5-3-2-4-6-19)23(30)25-17-7-9-18(10-8-17)27-13-11-20(29)12-14-27/h15,17-20,29H,2-14H2,1H3,(H,25,30)/t17-,18-
Show/Hide
|
||||||||||||||||||
| InChIKey |
MYJKENZQYMVSSC-IYARVYRRSA-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 | |||||||||||||||||||
| 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