FAIRMol

Library browser

Jasen preklop med dedupliciranimi compounds in posameznimi samples.
Open analysis
Compounds 5571 Samples 0
Search Workspace

Chemical search

Build a query, refine the result set, and sketch a structure without leaving the page.
Clear
Threshold 0.50

Properties

Reset all

Results

2 results for Pattern / motif query
Pattern / motif 2 results DB fairmol
Selected 0
Global compound selection stays available across the browser. Save selected compounds into analysis sets A / B / C, then use union, intersection or negation in the Analysis selection workbench.
Query interpretation
Pattern registry Vnos: alpha_haloketone α-Haloketone
ID 2280 DB fairmol
2D structure

ulfkktlib_1341

ID 2280

COC(=O)[C@@H](NC(=O)C(F)(F)F)c1cn2cccnc2n1

Formula: C11H9F3N4O3

MW: 302.21 | LogP: 0.62

TPSA: 85.59

Patterns:

α-Haloketone
Detail
ID 2628 DB fairmol
2D structure

ulfkktlib_1062

ID 2628

COC(=O)[C@H](C/C=N/Nc1nnc(Cl)c2ccccc12)NC(=O)C(F)(F)F

Formula: C15H13ClF3N5O3

MW: 403.75 | LogP: 2.29

TPSA: 105.57

Patterns:

α-Haloketone
Detail