ZINC26:Databases: Difference between revisions
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== Catalogs included in Batch search == | == Catalogs included in Batch search == | ||
Revision as of 19:44, 25 September 2026
Here are the databases currently included in ZINC26, as well as which are included in batch searches.
Purchasable Catalogs in ZINC26
Catalogs included in Batch search
| Batch Category | # files | size | Catalogs |
|---|---|---|---|
| Purchasable | 51 | 300B | Enamine REAL, ChemSpace FS5, WuXi GalaXi, |
| Bioactive | 3 | 1M | Drugbank, ChEMBL 1uM, Coconut, other NP |
In-Stock Catalog detail
We have 100s of vendors.
| Vendor | Catalog | size | status | Date |
|---|---|---|---|---|
| Various | In Stock | 20M | needs updating | see table below |
| Various | Covalent | 20M | needs updating | see table below |
| Various | BB | 20M | needs updating | see table below |
| - | Total | 100B |
BB Catalog Detail
| Vendor | Catalog | size | status | Date |
|---|---|---|---|---|
| Chem-Space | In-Stock | 500K | ||
| MolPort | In-Stock | 2M | ||
| Enamine | FastMADE | 120M | ||
| Enamine | 1.35B | |||
| - | Total | 100B |
Question: how many BB are there that are not covered by the above: Molport+ChemSpace+MADE ? We don't know, but we will find out.
Covalent Catalog Detail
| Vendor | Catalog | size | status | Date |
|---|---|---|---|---|
| Enamine | Covalent | 1B | ||
| - | Total | 1B |
So far, Enamine is the only reliable covalent vendor. There are in stock and on demand compounds. Let's add any other covalent vendors here, but warhead. Maybe we can fish them out of commercially available compounds?
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