General Information of the Compound
| Compound ID |
CP0374723
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[[4-[[1-di(propan-2-yloxy)phosphoryl-2,2-dimethylpropyl]amino]phenyl]methyl]adamantane-1-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H47N2O4P
|
||||||||||||||||||
| Molecular Weight |
518.679
|
||||||||||||||||||
| Canonical SMILES |
CC(C)OP(=O)(OC(C)C)C(Nc1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1)C(C)(C)C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H47N2O4P/c1-19(2)34-36(33,35-20(3)4)27(28(5,6)7)31-25-10-8-21(9-11-25)18-30-26(32)29-15-22-12-23(16-29)14-24(13-22)17-29/h8-11,19-20,22-24,27,31H,12-18H2,1-7H3,(H,30,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZXIKFOWXOKDIMY-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