Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9352227082-1
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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-3928960314-0
- Component type: Main
-
MCULE-4331301308-0
- Component type: Main
-
MCULE-5516854555-0
- Component type: Main
-
MCULE-9611905537-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9352227082-1.sdf |
| SMILES | MCULE-9352227082-1.smiles |
| Standard InChI | MCULE-9352227082-1.inchi |
| InChIKey | MCULE-9352227082-1.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-872825631 | 98 | As a main component | in stock |
| P-860605496 | 98 | As a main component | by synthesis |
| P-875698706 | N/A | As a main component | in stock |
| P-890143672 | N/A | As a main component | in stock |
| P-875688734 | N/A | As a main component | in stock |
| P-875831498 | N/A | As a main component | in stock |
| P-853432836 | 98 | As a main component | in stock |
| P-505393519 | 98 | As a main component | in stock |
| P-874642704 | 98 | As a main component | in stock |
| P-903059062 | N/A | As a main component | 9 kg |
| P-903021941 | 98 | As a main component | 500 g |
| P-903009682 | 98 | As a main component | 9.5 kg |
| P-903207392 | 98 | As a main component | 2.5 kg |
| P-870135903 | N/A | As a main component | in stock |
| P-851939785 | N/A | As a main component | in stock |
| P-867715760 | N/A | As a main component | in stock |
| P-872942572 | N/A | As a main component | in stock |
| P-606946431 | N/A | As a main component | in stock |
| P-489211678 | 97 | As a main component | in stock |
| P-489200228 | 97 | As a main component | in stock |
| P-881089576 | N/A | As a main component | unavailable |
| P-597006646 | 98 | As a main component | 7.5 kg |
| P-596973142 | 98 | As a main component | 7.5 kg |
| P-865903853 | 98 | As a main component | 300 g |
| P-895930680 | 95 | As a main component | by resynthesis (? - ? days) |
| P-895930480 | 95 | As a main component | by resynthesis (? - ? days) |
| P-895930537 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864146213 | 98 | As a main component | in stock |
| P-869391772 | 95 | As a main component | in stock |
| P-889588457 | 95 | As a main component | in stock |
| P-590637573 | 95 | As a main component | 3.225 kg |
| P-619603799 | 97 | As a main component | 1000 g |
| P-901462461 | 95 | As a main component | by synthesis |
| P-901462618 | 95 | As a main component | by synthesis |
| P-893235684 | 95 | As a main component | in stock |
| P-893237137 | 95 | As a main component | in stock |
| P-887195088 | 95 | As a main component | by synthesis |
| P-889029782 | 95 | As a main component | in stock |
| P-868602577 | 95 | As a main component | in stock |
| P-905351712 | 97 | As a main component | 957 g |
| P-1264322344 | 97 | As a main component | 20 g |
| P-889117301 | 95 | As a main component | 239 g |
| P-862093302 | 97 | As a main component | 957 g |
| P-905476653 | 95 | As a main component | by resynthesis (? - ? days) |
| P-579617388 | 95 | As a main component | unavailable |
| P-904641987 | 95 | As a main component | in stock |
| P-873280426 | N/A | As a main component | in stock |
| P-906759356 | 98 | As a main component | by synthesis |
| P-611360019 | 90 | As a main component | in stock |
| P-893968916 | 95 | As a main component | in stock |
| P-894009690 | 95 | As a main component | in stock |
| P-893965489 | 95 | As a main component | in stock |
| P-886903839 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 71.055 |
| logP | -1.0777 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 40.13 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 15.8905 |
| Atoms | 8 |
| Rings | 0 |
| Heavy atoms | 5 |
| Hydrogen atoms | 3 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
