MCULE-7444389843
- 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 | 3 USD | 98 | 14 working days | Get Quote |
| 5 mg | 3 USD | 98 | 14 working days | Get Quote |
| 10 mg | 3 USD | 98 | 14 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.
| Name | File |
|---|---|
| SDF | MCULE-7444389843.sdf |
| SMILES | MCULE-7444389843.smiles |
| Standard InChI | MCULE-7444389843.inchi |
| InChIKey | MCULE-7444389843.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867544348 | 98 | As is | in stock |
| P-872824833 | N/A | As is | by synthesis |
| P-901246264 | N/A | As is | by synthesis |
| P-875701783 | N/A | As is | in stock |
| P-597024648 | 98 | As is | in stock |
| P-869193979 | 95 | As is | in stock |
| P-505398101 | 97 | As is | in stock |
| P-903026112 | 98 | As is | 200 g |
| P-905479498 | 98 | As is | 100 g |
| P-893520362 | 90 | As is | 1.01005 kg |
| P-580237349 | 95 | As is | by synthesis |
| P-617048346 | 95 | As is | by resynthesis (? - ? days) |
| P-606839008 | N/A | As is | in stock |
| P-489140749 | 97 | As is | in stock |
| P-596939363 | 98 | As is | 500 g |
| P-888907034 | N/A | As is | in stock |
| P-866721590 | 95 | As is | by resynthesis (? - ? days) |
| P-864095547 | 95 | As is | in stock |
| P-580720392 | 98 | As is | 139.25 g |
| P-578621861 | 90 | As is | in stock |
| P-851238917 | 95 | As is | by synthesis |
| P-861275646 | 95 | As is | in stock |
| P-868564517 | 97 | As is | in stock |
| P-868572067 | 97 | As is | in stock |
| P-868643350 | 97 | As is | in stock |
| P-861300628 | 90 | As is | by synthesis |
| P-580424035 | 95 | As is | by resynthesis (? - ? days) |
| P-905330188 | 95 | As is | 15 g |
| P-861933714 | 95 | As is | 228.489 g |
| P-890221598 | 90 | As is | in stock |
| P-865985076 | 90 | As is | 1.5 g |
| P-505539905 | 95 | As is | in stock |
| P-502511124 | 95 | As is | by synthesis |
| P-503086060 | 90 | As is | by synthesis |
| P-502613452 | 90 | As is | in stock |
| P-18799272 | 90 | As is | 995 mg |
| P-856080300 | 95 | As is | by resynthesis (? - ? days) |
| P-613275965 | 95 | As is | by synthesis |
| P-601066543 | 90 | As is | 138 mg |
| P-580460772 | N/A | As is | by synthesis |
| P-852454635 | N/A | As is | in stock |
| P-35210935 | 90 | As is | 777 g |
| P-854736620 | 95 | As is | in stock |
| P-1263768105 | 95 | As is | in stock |
| P-888862562 | N/A | As is | in stock |
| P-885517323 | 95 | As is | by synthesis |
| P-520161276 | 90 | As is | in stock |
| P-596792357 | 95 | As is | 282.5 g |
| P-502364490 | 90 | As is | in stock |
| P-23301060 | 94 | As is | by resynthesis (? - ? days) |
| P-854958907 | 90 | As is | in stock |
| P-25728221 | 90 | As is | 312 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 152.176 |
| logP | 0.9846 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 73.99 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 40.2407 |
| Atoms | 14 |
| Rings | 2 |
| Heavy atoms | 10 |
| Hydrogen atoms | 4 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |

