General Information of the Compound
| Compound ID |
CP0349987
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US10568884, Cpd 26
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H29F2N7O4S
|
||||||||||||||||||
| Molecular Weight |
537.593
|
||||||||||||||||||
| Canonical SMILES |
CCS(=O)(=O)Nc1c(F)ccc(-c2nn(cc2-c2ccnc(NC[C@H](C)NC(=O)OC)n2)C(C)C)c1F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H29F2N7O4S/c1-6-37(34,35)31-21-17(24)8-7-15(19(21)25)20-16(12-32(30-20)13(2)3)18-9-10-26-22(29-18)27-11-14(4)28-23(33)36-5/h7-10,12-14,31H,6,11H2,1-5H3,(H,28,33)(H,26,27,29)/t14-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
MISNBEQFUJYEAG-AWEZNQCLSA-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