General Information of the Compound
| Compound ID |
CP0898529
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-{5-[3-(5-Fluoro-pyridin-3-yl)-1H-indazol-6-yl]-4-methyl-thiazol-2-yl}-2-(4-methyl-piperazin-1-yl)-acetamide
Show/Hide
|
||||||||||||||||||
| Formula |
C23H24FN7OS
|
||||||||||||||||||
| Molecular Weight |
465.558
|
||||||||||||||||||
| Canonical SMILES |
Cc1nc(NC(=O)CN2CCN(C)CC2)sc1-c1ccc2c(-c3cncc(F)c3)n[nH]c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H24FN7OS/c1-14-22(33-23(26-14)27-20(32)13-31-7-5-30(2)6-8-31)15-3-4-18-19(10-15)28-29-21(18)16-9-17(24)12-25-11-16/h3-4,9-12H,5-8,13H2,1-2H3,(H,28,29)(H,26,27,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZPSMCPKVGOVPEN-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 | |||||||||||||||||||
| 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
Protein ID: PT00934, High affinity nerve growth factor receptor
Protein ID: PT00864, Vascular endothelial growth factor receptor 2