General Information of the Compound
| Compound ID |
CP0366411
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-[[(1R,2S)-2-aminocyclohexyl]amino]-4-[(6-tert-butylpyridin-2-yl)amino]pyridazine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H29N7O
|
||||||||||||||||||
| Molecular Weight |
383.5
|
||||||||||||||||||
| Canonical SMILES |
CC(C)(C)c1cccc(Nc2cc(N[C@@H]3CCCC[C@@H]3N)nnc2C(N)=O)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H29N7O/c1-20(2,3)15-9-6-10-16(25-15)24-14-11-17(26-27-18(14)19(22)28)23-13-8-5-4-7-12(13)21/h6,9-13H,4-5,7-8,21H2,1-3H3,(H2,22,28)(H2,23,24,25,26)/t12-,13+/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
BCALBNNCQZJQOK-QWHCGFSZSA-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