Total results: 122
Property, Description, Tool, Available values. Total Hydrogen (H), The total number of hydrogen substituents. .H+ and .H-, H0-H4 and H4-H0.
However, if the --hitOrdering:g parameter is set, then this ordering is global over all search hits, in the order of R-atom numbers (R1 atom matches are ...
Query Guide. Organic chemistry grew rapidly during the 20th century, as evidenced by the increase in the number of known organic compounds from ...
The following SQL query returns the number of the structures that contain at least one benzene ring and have logP values greater than 9 SELECT count(*) FROM ...
Display Parameters. Parameter, Meaning, Default. addRemoveHatomsEnabled, Add ... queryAtoms, A comma-separated list of query atoms and properties. any - any ...
Refer to the JChem Query Guide for a detailed description of search options and query features. ... Values: d Default: its value is y in almost every cases. There ...
... queryAtom must match to targetAtom only or queryAtoms[0] must match. to ... Use the following command line parameter: --distinctFirstAtomMatching:n/y Default ...
An arbitrary SQL query can be specified as a filter for the filterQuery property. The (first) result column should contain the allowed cd_id values. Java ...
Optimize queries containing special query features (atom lists, bond lists, ...) ... Not applicable. ... Not applicable. ... Use the following command line parameter: ...
Atom number, atom map, atom property, atom query property values are displayed in the same row separated by semicolon. I/O. MOL file import: 2D clean of large ...