General Information of the Compound
| Compound ID |
CP0382263
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(3S,4R)-N-ethyl-4-[(4-ethylphenyl)sulfonylamino]-3-hydroxy-N-[(2-methoxyphenyl)methyl]-2,2-dimethyl-3,4-dihydropyrano[2,3-b]pyridine-6-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H35N3O6S
|
||||||||||||||||||
| Molecular Weight |
553.681
|
||||||||||||||||||
| Canonical SMILES |
CCN(Cc1ccccc1OC)C(=O)c1cnc2OC(C)(C)[C@@H](O)[C@H](NS(=O)(=O)c3ccc(CC)cc3)c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H35N3O6S/c1-6-19-12-14-22(15-13-19)39(35,36)31-25-23-16-21(17-30-27(23)38-29(3,4)26(25)33)28(34)32(7-2)18-20-10-8-9-11-24(20)37-5/h8-17,25-26,31,33H,6-7,18H2,1-5H3/t25-,26+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
DFDCYCBZUZPLTE-FTJBHMTQSA-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