General Information of the Compound
| Compound ID |
CP0468583
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-[4-[2-[[6-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]furo[2,3-d]pyrimidin-4-yl]amino]ethyl]phenyl]-3-phenylurea
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C34H37N7O3
|
||||||||||||||||||
| Molecular Weight |
591.716
|
||||||||||||||||||
| Canonical SMILES |
CN1CCN(CCOc2ccc(cc2)-c2cc3c(NCCc4ccc(NC(=O)Nc5ccccc5)cc4)ncnc3o2)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C34H37N7O3/c1-40-17-19-41(20-18-40)21-22-43-29-13-9-26(10-14-29)31-23-30-32(36-24-37-33(30)44-31)35-16-15-25-7-11-28(12-8-25)39-34(42)38-27-5-3-2-4-6-27/h2-14,23-24H,15-22H2,1H3,(H,35,36,37)(H2,38,39,42)
Show/Hide
|
||||||||||||||||||
| InChIKey |
PRBZWJDAVYGYMK-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