General Information of the Compound
| Compound ID |
CP0959684
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
SID85798007
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H36F3N5O5
|
||||||||||||||||||
| Molecular Weight |
603.642
|
||||||||||||||||||
| Canonical SMILES |
Cc1noc(C)c1NC(=O)Nc1cccc2c1O[C@H](CN(C)Cc1ccc(C(F)(F)F)cc1)[C@H](C)CN([C@@H](C)CO)C2=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H36F3N5O5/c1-17-13-38(18(2)16-39)28(40)23-7-6-8-24(34-29(41)35-26-19(3)36-43-20(26)4)27(23)42-25(17)15-37(5)14-21-9-11-22(12-10-21)30(31,32)33/h6-12,17-18,25,39H,13-16H2,1-5H3,(H2,34,35,41)/t17-,18+,25-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
RQWZPZKMXFSKNS-FUMQJTLXSA-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