General Information of the Compound
| Compound ID |
CP0219131
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-(cyclopropylmethoxy)-2-[2-[[2-[2-(1,2,3,4-tetrahydroacridin-9-ylamino)ethylamino]acetyl]amino]pyridin-4-yl]-1,3-thiazole-5-carboxamide
Show/Hide
|
||||||||||||||||||
| Formula |
C30H33N7O3S
|
||||||||||||||||||
| Molecular Weight |
571.707
|
||||||||||||||||||
| Canonical SMILES |
NC(=O)c1sc(nc1OCC1CC1)-c1ccnc(NC(=O)CNCCNc2c3CCCCc3nc3ccccc23)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H33N7O3S/c31-28(39)27-29(40-17-18-9-10-18)37-30(41-27)19-11-12-33-24(15-19)36-25(38)16-32-13-14-34-26-20-5-1-3-7-22(20)35-23-8-4-2-6-21(23)26/h1,3,5,7,11-12,15,18,32H,2,4,6,8-10,13-14,16-17H2,(H2,31,39)(H,34,35)(H,33,36,38)
Show/Hide
|
||||||||||||||||||
| InChIKey |
FOAOMODSQTYPSH-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