General Information of the Compound
| Compound ID |
CP0522780
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-methyl-1-(8-(2-(4-phenyl-1-(1H-tetrazol-5-yl)piperidin-4-yl)ethyl)-8-azabicyclo[3.2.1]octan-3-yl)-1H-benzo[d]imidazole
Show/Hide
|
||||||||||||||||||
| Formula |
C29H36N8
|
||||||||||||||||||
| Molecular Weight |
496.663
|
||||||||||||||||||
| Canonical SMILES |
Cc1nc2ccccc2n1[C@@H]1C[C@@H]2CC[C@H](C1)N2CCC1(CCN(CC1)c1nnn[nH]1)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H36N8/c1-21-30-26-9-5-6-10-27(26)37(21)25-19-23-11-12-24(20-25)36(23)18-15-29(22-7-3-2-4-8-22)13-16-35(17-14-29)28-31-33-34-32-28/h2-10,23-25H,11-20H2,1H3,(H,31,32,33,34)/t23-,24+,25+
Show/Hide
|
||||||||||||||||||
| InChIKey |
JQOORFUSHXGUAK-LNWKWYTESA-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 | |||||||||||||||||||
| 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