General Information of the Compound
| Compound ID |
CP0483863
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(3R,4S)-3-hydroxyoxan-4-yl]-1,6-dimethyl-2-oxo-5-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Formula |
C23H26N4O4
|
||||||||||||||||||
| Molecular Weight |
422.485
|
||||||||||||||||||
| Canonical SMILES |
Cc1c(Cc2ccc(cc2)-n2cccn2)cc(C(=O)N[C@H]2CCOC[C@@H]2O)c(=O)n1C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H26N4O4/c1-15-17(12-16-4-6-18(7-5-16)27-10-3-9-24-27)13-19(23(30)26(15)2)22(29)25-20-8-11-31-14-21(20)28/h3-7,9-10,13,20-21,28H,8,11-12,14H2,1-2H3,(H,25,29)/t20-,21-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
VPRNLXJMSMJYHA-SFTDATJTSA-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 | |||||||||||||||||||
| 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