General Information of the Compound
| Compound ID |
CP0518747
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(4-methoxynaphthalen-1-yl)sulfonyl-N-methyl-N-(1-methylpiperidin-4-yl)-2,3-dihydroindole-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H31N3O4S
|
||||||||||||||||||
| Molecular Weight |
493.629
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(c2ccccc12)S(=O)(=O)N1CC(C(=O)N(C)C2CCN(C)CC2)c2ccccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H31N3O4S/c1-28-16-14-19(15-17-28)29(2)27(31)23-18-30(24-11-7-6-8-20(23)24)35(32,33)26-13-12-25(34-3)21-9-4-5-10-22(21)26/h4-13,19,23H,14-18H2,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
WCMJQWVGKBVEQR-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