Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1646830516-0
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 | 36 USD | 99 | 6 working days | Get Quote |
| 5 mg | 36 USD | 99 | 6 working days | Get Quote |
| 10 mg | 36 USD | 99 | 6 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.
-
1
MCULE-4489292957-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1646830516-0.sdf |
| SMILES | MCULE-1646830516-0.smiles |
| Standard InChI | MCULE-1646830516-0.inchi |
| InChIKey | MCULE-1646830516-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-872825874 | 95 | As is | in stock |
| P-867398739 | N/A | As is | by synthesis |
| P-875703523 | N/A | As is | in stock |
| P-611623713 | 99 | As is | in stock |
| P-903028440 | 97 | As is | 5 g |
| P-610978720 | 90 | As is | 25.25 g |
| P-893546488 | 90 | As is | 910.489 g |
| P-851539312 | N/A | As is | by synthesis |
| P-619200512 | 97 | As is | 5 g |
| P-869388906 | 95 | As is | in stock |
| P-590795826 | 95 | As is | by synthesis |
| P-901550788 | 95 | As is | by synthesis |
| P-901550798 | 95 | As is | by synthesis |
| P-855379993 | 90 | As is | 5.2 g |
| P-890221265 | 90 | As is | in stock |
| P-454331989 | 95 | As is | 7.381 g |
| P-870641081 | 95 | As is | 100 mg |
| P-454315976 | 95 | As is | 3.44 g |
| P-454408013 | 95 | As is | 7.381 g |
| P-454400340 | 95 | As is | 3.44 g |
| P-855918469 | 97 | As is | 1000 mg |
| P-855920305 | 95 | As is | 5 g |
| P-860797250 | 95 | As is | 10 g |
| P-895270732 | 95 | As is | by synthesis |
| P-611394055 | 90 | As is | in stock |
| P-868507227 | 95 | As is | in stock |
| P-872759371 | 95 | As is | in stock |
| P-886910461 | 95 | As is | in stock |
| P-867594875 | 95 | Main component | in stock |
| P-875753297 | N/A | Main component | in stock |
| P-869281280 | 95 | Main component | in stock |
| P-610907813 | 90 | Main component | by synthesis |
| P-875897168 | N/A | Main component | in stock |
| P-851710043 | N/A | Main component | by synthesis |
| P-881038355 | 95 | Main component | in stock |
| P-492253023 | 95 | Main component | in stock |
| P-864473931 | 90 | Main component | 50 mg |
| P-905339997 | 99 | Main component | 6.5 g |
| P-893294532 | 95 | Main component | 1.067 g |
| P-563574277 | 95 | Main component | 5 g |
| P-855916505 | 95 | Main component | 250 mg |
| P-856090429 | 95 | Main component | unavailable |
| P-428075252 | 90 | Main component | 647 g |
| P-854790543 | 95 | Main component | by synthesis |
| P-859998906 | 95 | Main component | by synthesis |
| P-611557768 | 90 | Main component | in stock |
| P-893981629 | 95 | Main component | in stock |
| P-590447221 | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 147.644 |
| logP | 2.636 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 26.02 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 41.2074 |
| Atoms | 23 |
| Rings | 2 |
| Heavy atoms | 9 |
| Hydrogen atoms | 14 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 3 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 3 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
