General Information of the Compound
| Compound ID |
CP0237631
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(3S,4R)-1-acetyl-N-hydroxy-3-methyl-4-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylamino]piperidine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H30N4O6S
|
||||||||||||||||||
| Molecular Weight |
526.615
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)N1CC[C@@H](NS(=O)(=O)c2ccc(OCc3cc(C)nc4ccccc34)cc2)[C@](C)(C1)C(=O)NO
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H30N4O6S/c1-17-14-19(22-6-4-5-7-23(22)27-17)15-36-20-8-10-21(11-9-20)37(34,35)29-24-12-13-30(18(2)31)16-26(24,3)25(32)28-33/h4-11,14,24,29,33H,12-13,15-16H2,1-3H3,(H,28,32)/t24-,26+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
JKJJVHPDOQOUJG-RSXGOPAZSA-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