Specify Sample Amount Individually for Each Item in List Search

MolPort List Search is a tool, available on the MolPort homepage, which aims to simplify the sourcing of a list of reagents or HTS samples. If you have compound structures in form of an SD file, a SMILES string list, or a list of MolPort ID references, you can do a quick search and optimize the shopping cart in real time.  See the List Search user guide. However, your specified sample amount applies to all compounds by default, which is great for HTS compounds, but may not be the optimal way to order building blocks.

On user demand, we added the feature to specify required sample amounts for individual compound in List Search. This is an example compound list:

Ref Nr	SMILES	Required amount, mg	Minimum acceptable amount, mg
LID2828	NC(C(O)=O)c1ccc2OCCOc2c1	300	100
LID1617	NC(C(O)=O)c1ccc(cc1)-c1ccccc1	300	100
LID2982	NC(C(O)=O)c1cccc(c1)[N+]([O-])=O	1000	100
LID4215	CC(C)(C)OC(=O)NC1CCCCC1N	800	100
LID3556	NC(C(O)=O)c1cccnc1	500	100
LID2377	COc1ccccc1C(N)C(O)=O	1000	100
LID4350	NC(C(O)=O)c1ccccc1F	700	100
LID2486	CC(C)(C)OC(=O)N1CCCCCC1C(O)=O	200	100
LID3074	NC(C1CCCCC1)C(O)=O	800	100
LID1893	NC(C1CC1)C(O)=O	100	100
LID2888	OC1CCCNCC1	300	100
LID2027	NC(C(O)=O)c1ccc2ccccc2c1	900	100
LID2759	CC(N)=N	200	100
LID0164	NC(C(O)=O)c1ccc(F)cc1	900	100
LID2173	NC(C(O)=O)c1ccc(cc1)C(F)(F)F	300	100
LID1590	Cl.NC(=N)C12CC3CC(CC(C3)C1)C2	800	100
LID4312	NC(C(O)=O)c1ccccc1Cl	300	100

Where:

Ref Nr	Your reference number for the compound.
SMILES	Specifies the structure of the compound.
Required amount	This is the desired sample amount of the compound in milligrams (other measurement units should be converted to milligrams to use this feature).
Minimum acceptable amount	Should the required amount of the compound is not available, you can specify the minimum amount you would be interested in. The sourced amount will be within the range of the Minimum acceptable amount and the Required amount. If the available sample amount is less than this quantity, the compound will be listed as unavailable.

Results of a List Search:

After specifying the desired amounts for separate compounds, you can either finish the ordering process online or generate a quote for creating a purchase order through your Purchasing Department.