General Information of the Compound
| Compound ID |
CP0909181
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
SID131448024
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H27N3O2
|
||||||||||||||||||
| Molecular Weight |
377.488
|
||||||||||||||||||
| Canonical SMILES |
CN(C[C@H]1N[C@@H](CO)[C@@H]1c1ccc(C2=CCCC2)cc1)C(=O)c1ccncc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H27N3O2/c1-26(23(28)19-10-12-24-13-11-19)14-20-22(21(15-27)25-20)18-8-6-17(7-9-18)16-4-2-3-5-16/h4,6-13,20-22,25,27H,2-3,5,14-15H2,1H3/t20-,21+,22-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
XSFWAVUYQBWYGE-BHIFYINESA-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