General Information of the Compound
| Compound ID |
CP0968277
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(1-ethyl-2-(hydroxydiphenylmethyl)-1H-benzo[d]imidazol-6-yl)(4-methylpiperazin-1-yl)methanone
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H30N4O2
|
||||||||||||||||||
| Molecular Weight |
454.574
|
||||||||||||||||||
| Canonical SMILES |
CCn1c(C(O)(c2ccccc2)c2ccccc2)nc2ccc(C(=O)N3CCN(C)CC3)cc21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H30N4O2/c1-3-32-25-20-21(26(33)31-18-16-30(2)17-19-31)14-15-24(25)29-27(32)28(34,22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-15,20,34H,3,16-19H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
HRBPYOMISWLSIR-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