General Information of the Compound
| Compound ID |
CP0494249
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N'-(3-ethyl-1-adamantyl)-4-(trifluoromethyl)benzohydrazide
Show/Hide
|
||||||||||||||||||
| Formula |
C20H25F3N2O
|
||||||||||||||||||
| Molecular Weight |
366.427
|
||||||||||||||||||
| Canonical SMILES |
CCC12CC3CC(C1)CC(C3)(C2)NNC(=O)c1ccc(cc1)C(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H25F3N2O/c1-2-18-8-13-7-14(9-18)11-19(10-13,12-18)25-24-17(26)15-3-5-16(6-4-15)20(21,22)23/h3-6,13-14,25H,2,7-12H2,1H3,(H,24,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
TVRAWMUKPGMPSP-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 | |||||||||||||||||||
| 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