Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3448327242-0
Structure
Show compound
In order to add this molecule to a collection you have to create an account.
Sign up for free
- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 15 USD | 99 | 15 working days | Get Quote |
| 5 mg | 32 USD | 99 | 14 working days | Get Quote |
| 10 mg | 55 USD | 99 | 15 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
-
MCULE-9366852546-0
- Component type: Main
-
MCULE-4805710010-0
- Component type: Main
-
MCULE-3889286634-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3448327242-0.sdf |
| SMILES | MCULE-3448327242-0.smiles |
| Standard InChI | MCULE-3448327242-0.inchi |
| InChIKey | MCULE-3448327242-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-901294336 | 99 | As is | in stock |
| P-881621199 | N/A | As is | by synthesis |
| P-1273294367 | 95 | As is | by resynthesis (? - ? days) |
| P-869420314 | 95 | As is | by synthesis |
| P-868544774 | 99 | As is | in stock |
| P-890229133 | 97 | As is | by synthesis |
| P-1264392657 | 95 | As is | in stock |
| P-491318805 | 95 | As is | by synthesis |
| P-1274334265 | 95 | As is | unavailable |
| P-1274343345 | 95 | As is | 1.785 g |
| P-1274355000 | 95 | As is | 98 mg |
| P-611497542 | 90 | As is | in stock |
| P-1271504364 | 95 | As is | by synthesis |
| P-867679718 | 99 | As a main component | in stock |
| P-875857271 | 99 | As a main component | in stock |
| P-869318213 | 95 | As a main component | by resynthesis (? - ? days) |
| P-872725257 | 98 | As a main component | in stock |
| P-903310108 | 99 | As a main component | 150 mg |
| P-1264053797 | 99 | As a main component | in stock |
| P-893607703 | 90 | As a main component | 3.212 g |
| P-1270362998 | 99 | As a main component | in stock |
| P-606920248 | N/A | As a main component | in stock |
| P-865932092 | 99 | As a main component | 10 mg |
| P-1273451106 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1273457990 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864182335 | 95 | As a main component | in stock |
| P-584627601 | 99 | As a main component | 29 mg |
| P-851314925 | 95 | As a main component | by synthesis |
| P-860800379 | 98 | As a main component | in stock |
| P-580451247 | 98 | As a main component | in stock |
| P-861368256 | 95 | As a main component | by synthesis |
| P-579482261 | 95 | As a main component | in stock |
| P-854621144 | 98 | As a main component | in stock |
| P-901410664 | 99 | As a main component | 30 mg |
| P-868079129 | 95 | As a main component | in stock |
| P-1273109902 | 95 | As a main component | 100 mg |
| P-1264392961 | 95 | As a main component | in stock |
| P-854717103 | 95 | As a main component | in stock |
| P-1272497434 | 95 | As a main component | by synthesis |
| P-584614082 | 95 | As a main component | in stock |
| P-878641157 | 98 | As a main component | in stock |
| P-617403912 | 98 | As a main component | in stock |
| P-1274345356 | 95 | As a main component | unavailable |
| P-892295215 | 95 | As a main component | unavailable |
| P-1274356474 | 95 | As a main component | unavailable |
| P-869161224 | 95 | As a main component | 49 mg |
| P-888656454 | 95 | As a main component | 49 mg |
| P-596714334 | 90 | As a main component | 1 mg |
| P-906796181 | 95 | As a main component | by synthesis |
| P-1271689563 | 99 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 463.329 |
| logP | 4.5813 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 90.05 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 123.8314 |
| Atoms | 49 |
| Rings | 5 |
| Heavy atoms | 30 |
| Hydrogen atoms | 19 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
