General Information of the Compound
| Compound ID |
CP0571211
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(3S)-1-(cyclobutylamino)-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-1-oxopentan-3-yl]-1-cyclopentyl-5-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H38F3N5O3
|
||||||||||||||||||
| Molecular Weight |
573.66
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CC2(COC2)C1)CC(=O)NC1CCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H38F3N5O3/c31-30(32,33)24-11-4-3-10-23(24)26-15-25(36-38(26)22-8-1-2-9-22)28(40)35-21(14-27(39)34-20-6-5-7-20)12-13-37-16-29(17-37)18-41-19-29/h3-4,10-11,15,20-22H,1-2,5-9,12-14,16-19H2,(H,34,39)(H,35,40)/t21-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
LPWZUBREIBTPHZ-NRFANRHFSA-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 | |||||||||||||||||||
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