General Information of the Compound
| Compound ID |
CP0886272
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
SID87541988
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C33H47F3N4O5
|
||||||||||||||||||
| Molecular Weight |
636.756
|
||||||||||||||||||
| Canonical SMILES |
CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)cc2C(=O)N([C@H](C)CO)C[C@H]1C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C33H47F3N4O5/c1-6-16-39(5)20-30-22(2)19-40(23(3)21-41)31(42)28-18-27(14-15-29(28)45-24(4)9-7-8-17-44-30)38-32(43)37-26-12-10-25(11-13-26)33(34,35)36/h10-15,18,22-24,30,41H,6-9,16-17,19-21H2,1-5H3,(H2,37,38,43)/t22-,23-,24-,30-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
GBZUPZRZKNXASB-NULUGNBJSA-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