UCSF

All Special Subsets (8 in total)

Ready-to-download special subsets of ZINC are available below. Click on the subset name to go to the download page. Click on the number of compounds to browse. These subsets contain only molecules that are purchasable. Natural products and their derivatives, which are often isolated rather than synthesized, may be surprisingly expensive if you are used to the price of synthetic screening compounds. More about ZINC subsets is here.
 
ZINC may be used free of charge for research by individuals and institutions. Whereas you are free to share the results of a ZINC search or a screen of molecules from ZINC, you may not redistribute major portions of ZINC without the express written permission of John Irwin.
# Name Comments Size Last
Updated		 Selection Criteria Browse Download Usual Subset
96 Zdd ZINC Drug Database - Worldwide approved drugs you can buy as pure compound 6869 2011-12-14 c.cat_id in (219,217,482,178,324,104) Overview Basic SMILES SDF MOL2 Flexibase
97 Zmd ZINC Metabolite Database - All commercially available metabolites 11728 2011-12-14 c.cat_id in (224,90,507,460) Overview Basic SMILES SDF MOL2 Flexibase
98 Znp ZINC Natural Products - All commercially available natural products - including metabolites 199774 2011-12-15 c.cat_id in (176,509,525,23,453, 493,501,503,505,517, 519,521,523,224,90, 507,460) Overview Basic SMILES SDF MOL2 Flexibase
99 Zbb ZINC Building Blocks - All commercially available synthetic building blocks 2148074 2011-12-19 c.cat_id in (116,58,278,289, 297,302,304,306,311, 317,326,328,332,334, 336,343,347,362,368, 370,372,374,389,391, 446,447,496,497,499, 599,503,531) Overview Basic SMILES SDF MOL2 Flexibase
100 Zbb Now ZINC Building Blocks Now - Building blocks for immediate delivery 351919 2011-12-15 c.cat_id in (116,58,278,297, 302,304,306,311,317, 326,328,332,334,336, 343,347,362,368,370, 372,374,389,447,497, 599,503) Overview Basic SMILES SDF MOL2 Flexibase
101 Znd ZINC Natural Derivatives - Natural Product Derivatives - chemically modified natural products 4919 2011-12-14 c.cat_id in (533,527) Overview Basic SMILES SDF MOL2 Flexibase
103 Znplike ZINC Natural Product Like - 80% similar to NP or their 10+ atom fragments 439979 2012-01-18 #see comment# Overview Basic SMILES SDF MOL2 Flexibase
104 Zim ZINC In Man - experimental compounds that have been in man, worldwide (includes approved drugs) 16394 2011-12-14 c.cat_id in (103,178,218,219,324,482,217,104) Overview Basic SMILES SDF MOL2 Flexibase