General Information of the Compound
| Compound ID |
CP0889300
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
SID85148967
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C32H30FN3O4
|
||||||||||||||||||
| Molecular Weight |
539.607
|
||||||||||||||||||
| Canonical SMILES |
COC(=O)C1=C(c2ccc(F)cc2OCc2ccccc2)C[C@@H]2CC[C@H]1N2C(=O)NCc1ccc2[nH]ccc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C32H30FN3O4/c1-39-31(37)30-26(25-10-8-23(33)16-29(25)40-19-20-5-3-2-4-6-20)17-24-9-12-28(30)36(24)32(38)35-18-21-7-11-27-22(15-21)13-14-34-27/h2-8,10-11,13-16,24,28,34H,9,12,17-19H2,1H3,(H,35,38)/t24-,28+/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
FHZQRIVGARXRAR-RBJSKKJNSA-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