General Information of the Compound
| Compound ID |
CP0392423
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-amino-4-[cyclohexyl(2-hydroxyethyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H20N6O
|
||||||||||||||||||
| Molecular Weight |
300.366
|
||||||||||||||||||
| Canonical SMILES |
Nc1nc(N(CCO)C2CCCCC2)c2c(c[nH]c2n1)C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H20N6O/c16-8-10-9-18-13-12(10)14(20-15(17)19-13)21(6-7-22)11-4-2-1-3-5-11/h9,11,22H,1-7H2,(H3,17,18,19,20)
Show/Hide
|
||||||||||||||||||
| InChIKey |
USTRGQRKAKECMH-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 | |||||||||||||||||||
| 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