General Information of the Compound
| Compound ID |
CP0445994
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(R)-N-(5-guanidino-1-oxo-1-(4-(trifluoromethyl)benzylamino)pentan-2-yl)-9H-fluorene-9-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H28F3N5O2
|
||||||||||||||||||
| Molecular Weight |
523.559
|
||||||||||||||||||
| Canonical SMILES |
NC(=N)NCCC[C@@H](NC(=O)C1c2ccccc2-c2ccccc12)C(=O)NCc1ccc(cc1)C(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H28F3N5O2/c29-28(30,31)18-13-11-17(12-14-18)16-35-25(37)23(10-5-15-34-27(32)33)36-26(38)24-21-8-3-1-6-19(21)20-7-2-4-9-22(20)24/h1-4,6-9,11-14,23-24H,5,10,15-16H2,(H,35,37)(H,36,38)(H4,32,33,34)/t23-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
QYYXGFNZDHJZHM-HSZRJFAPSA-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