General Information of the Compound
| Compound ID |
CP0570788
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(3R)-1-[3-(3,4-dimethoxyphenyl)-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl]pyrrolidin-3-amine;hydrochloride
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H26ClN5O2
|
||||||||||||||||||
| Molecular Weight |
403.914
|
||||||||||||||||||
| Canonical SMILES |
Cl.COc1ccc(cc1OC)-c1c(C)nc2c(cc(C)nn12)N1CC[C@@H](N)C1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H25N5O2.ClH/c1-12-9-16(24-8-7-15(21)11-24)20-22-13(2)19(25(20)23-12)14-5-6-17(26-3)18(10-14)27-4;/h5-6,9-10,15H,7-8,11,21H2,1-4H3;1H/t15-;/m1./s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
LCNNGNDZRGRJHU-XFULWGLBSA-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