General Information of the Compound
| Compound ID |
CP0880805
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(Cyclopropylmethyl)-N-[(2,2-dimethyl-2H-chromen-6-yl)-methyl]pyridine-2-sulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H24N2O3S
|
||||||||||||||||||
| Molecular Weight |
384.501
|
||||||||||||||||||
| Canonical SMILES |
CC1(C)C=Cc2cc(CN(CC3CC3)S(=O)(=O)c3ccccn3)ccc2O1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H24N2O3S/c1-21(2)11-10-18-13-17(8-9-19(18)26-21)15-23(14-16-6-7-16)27(24,25)20-5-3-4-12-22-20/h3-5,8-13,16H,6-7,14-15H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
SFUURBFVCGXYBS-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