General Information of the Compound
| Compound ID |
CP0070777
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-N-benzyl-6-(3-methylbutyl)-4-N-(2-methylpropyl)pyrimidine-2,4-diamine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H30N4
|
||||||||||||||||||
| Molecular Weight |
326.488
|
||||||||||||||||||
| Canonical SMILES |
CC(C)CCc1cc(NCC(C)C)nc(NCc2ccccc2)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H30N4/c1-15(2)10-11-18-12-19(21-13-16(3)4)24-20(23-18)22-14-17-8-6-5-7-9-17/h5-9,12,15-16H,10-11,13-14H2,1-4H3,(H2,21,22,23,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CHSZLIPRBWRPMR-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