General Information of the Compound
| Compound ID |
CP0953885
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(3-(3-(4-hydroxyphenyl)pentan-3-yl)-1H-indol-7-yl)methanesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H24N2O3S
|
||||||||||||||||||
| Molecular Weight |
372.49
|
||||||||||||||||||
| Canonical SMILES |
CCC(CC)(c1ccc(O)cc1)c1c[nH]c2c(NS(C)(=O)=O)cccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H24N2O3S/c1-4-20(5-2,14-9-11-15(23)12-10-14)17-13-21-19-16(17)7-6-8-18(19)22-26(3,24)25/h6-13,21-23H,4-5H2,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
LWKGAONEVXEDIW-UHFFFAOYSA-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