General Information of the Compound
| Compound ID |
CP0404458
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-[3-[2-[(5,6-diphenylfuro[2,3-d]pyrimidin-4-yl)amino]ethyl]phenyl]-3-phenylurea
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C33H27N5O2
|
||||||||||||||||||
| Molecular Weight |
525.612
|
||||||||||||||||||
| Canonical SMILES |
O=C(Nc1ccccc1)Nc1cccc(CCNc2ncnc3oc(c(-c4ccccc4)c23)-c2ccccc2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C33H27N5O2/c39-33(37-26-16-8-3-9-17-26)38-27-18-10-11-23(21-27)19-20-34-31-29-28(24-12-4-1-5-13-24)30(25-14-6-2-7-15-25)40-32(29)36-22-35-31/h1-18,21-22H,19-20H2,(H,34,35,36)(H2,37,38,39)
Show/Hide
|
||||||||||||||||||
| InChIKey |
VGXRCDITQXUDTO-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