General Information of the Compound
| Compound ID |
CP0912290
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
SID131461102
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H27FN2O2
|
||||||||||||||||||
| Molecular Weight |
430.523
|
||||||||||||||||||
| Canonical SMILES |
CN1c2ccc(-c3cccc(F)c3)cc2[C@@H]2[C@@H](CCN2C(=O)Cc2ccccc2)[C@@H]1CO
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H27FN2O2/c1-29-24-11-10-20(19-8-5-9-21(28)15-19)16-23(24)27-22(25(29)17-31)12-13-30(27)26(32)14-18-6-3-2-4-7-18/h2-11,15-16,22,25,27,31H,12-14,17H2,1H3/t22-,25-,27-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
LOOHRKFZWCKLPQ-LNBJVWSJSA-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