General Information of the Compound
| Compound ID |
CP0001206
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2,6,9-Trisubstituted purine deriv. 26
Show/Hide
|
||||||||||||||||||
| Synonyms |
101622-51-9
2-(2-Hydroxyethylamino)-6-benzylamino-9-methylpurine
2-(Hydroxyethylamino)-6-benzylamino-9-methylpurine
2-{[6-(benzylamino)-9-methyl-9h-purin-2-yl]amino}ethanol
4erk
6-(Benzylamino)-2-(2-hydroxyethylamino)-9-methylpurine
6-Benylamino-2-(2-hydroxyethylamino)-9-methylpurine
6-Benzylamino-2-(2-hydroxyethylamino)-9-methylpurine
6A839B2HYS
CHEMBL280074
Ethanol,2-[[9-methyl-6-[(phenylmethyl)amino]-9H-purin-2-yl]amino]-
OLO
Olomoucine
UNII-6A839B2HYS
olomoucine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H18N6O
|
||||||||||||||||||
| Molecular Weight |
298.35
|
||||||||||||||||||
| Canonical SMILES |
Cn1cnc2c(NCc3ccccc3)nc(NCCO)nc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H18N6O/c1-21-10-18-12-13(17-9-11-5-3-2-4-6-11)19-15(16-7-8-22)20-14(12)21/h2-6,10,22H,7-9H2,1H3,(H2,16,17,19,20)
Show/Hide
|
||||||||||||||||||
| InChIKey |
GTVPOLSIJWJJNY-UHFFFAOYSA-N
|
||||||||||||||||||
| CAS |
101622-51-9
|
||||||||||||||||||
| 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 | |||||||||||||||||||
| DrugBank 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
Clinical Information about the Compound