General Information of the Compound
| Compound ID |
CP0904604
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-((4-ethyl-3-methyl-2-(p-tolylimino)-6-(trifluoromethyl)-2,3-dihydro-1H-benzo[d]imidazol-1-yl)methyl)-N-(1H-tetrazol-5-yl)benzamide
Show/Hide
|
||||||||||||||||||
| Formula |
C27H25F3N8O
|
||||||||||||||||||
| Molecular Weight |
534.546
|
||||||||||||||||||
| Canonical SMILES |
CCc1cc(C(F)(F)F)cc2c1n(C)/c(=N/c1ccc(C)cc1)n2Cc1ccc(C(=O)Nc2nnn[nH]2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H25F3N8O/c1-4-18-13-20(27(28,29)30)14-22-23(18)37(3)26(31-21-11-5-16(2)6-12-21)38(22)15-17-7-9-19(10-8-17)24(39)32-25-33-35-36-34-25/h5-14H,4,15H2,1-3H3,(H2,32,33,34,35,36,39)/b31-26-
Show/Hide
|
||||||||||||||||||
| InChIKey |
WOURZOXAQQKDEF-ZXPTYKNPSA-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