General Information of the Compound
| Compound ID |
CP0870583
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-ethyl-N-((1R,3R)-3-hydroxycyclohexyl)-2-(hydroxydiphenylmethyl)-1H-benzo[d]imidazole-6-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H31N3O3
|
||||||||||||||||||
| Molecular Weight |
469.585
|
||||||||||||||||||
| Canonical SMILES |
CCn1c(C(O)(c2ccccc2)c2ccccc2)nc2ccc(C(=O)N[C@@H]3CCC[C@@H](O)C3)cc21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H31N3O3/c1-2-32-26-18-20(27(34)30-23-14-9-15-24(33)19-23)16-17-25(26)31-28(32)29(35,21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-8,10-13,16-18,23-24,33,35H,2,9,14-15,19H2,1H3,(H,30,34)/t23-,24-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
GELVMWSKEXREHM-DNQXCXABSA-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