Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4937391812
Compound
Show structure
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 | 22 USD | 95 | 15 working days | Get Quote |
| 5 mg | 22 USD | 95 | 15 working days | Get Quote |
| 10 mg | 22 USD | 95 | 15 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-2517288272
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4937391812.sdf |
| SMILES | MCULE-4937391812.smiles |
| Standard InChI | MCULE-4937391812.inchi |
| InChIKey | MCULE-4937391812.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886691969 | 95 | As is | in stock |
| P-889993302 | N/A | As is | by synthesis |
| P-869201073 | 95 | As is | in stock |
| P-903259381 | 95 | As is | 5 g |
| P-851715941 | N/A | As is | by synthesis |
| P-611068576 | 95 | As is | by synthesis |
| P-901481912 | 95 | As is | by synthesis |
| P-861387836 | 95 | As is | by synthesis |
| P-854792329 | 95 | As is | by synthesis |
| P-611400359 | 90 | As is | in stock |
| P-893743189 | 95 | As is | by synthesis |
| P-867593039 | 95 | Main component | in stock |
| P-875751983 | N/A | Main component | in stock |
| P-590393581 | 95 | Main component | in stock |
| P-903083773 | 97 | Main component | 5 g |
| P-610977646 | 90 | Main component | 21.1 g |
| P-606910410 | N/A | Main component | in stock |
| P-489188993 | 97 | Main component | in stock |
| P-596956370 | 97 | Main component | 5 g |
| P-596498007 | 90 | Main component | 1000 mg |
| P-596458880 | 90 | Main component | 1000 mg |
| P-864103954 | 95 | Main component | in stock |
| P-580701996 | 95 | Main component | 2.65 g |
| P-851264851 | 95 | Main component | by synthesis |
| P-868581543 | 98 | Main component | in stock |
| P-580415459 | 95 | Main component | by resynthesis (? - ? days) |
| P-454319354 | 90 | Main component | unavailable |
| P-608101768 | 95 | Main component | 5 g |
| P-580476491 | N/A | Main component | by synthesis |
| P-852402527 | N/A | Main component | in stock |
| P-854792328 | 95 | Main component | by synthesis |
| P-596782882 | 95 | Main component | 6.25 g |
| P-502334953 | 90 | Main component | in stock |
| P-33602539 | 94 | Main component | by resynthesis (? - ? days) |
| P-906829832 | 95 | Main component | by synthesis |
| P-855302759 | 90 | Main component | in stock |
| P-575301656 | 95 | Main component | in stock |
| P-852081256 | 95 | Main component as a main component | by synthesis |
| P-894620154 | 95 | Main component as a main component | in stock |
| P-494349828 | 95 | Main component as a main component | 570 mg |
| P-454350972 | 95 | Main component as a main component | 137 mg |
| P-454416752 | 95 | Main component as a main component | 1000 mg |
| P-852547081 | N/A | Main component as a main component | in stock |
| P-519754366 | 95 | Main component as a main component | 26 g |
| P-428013435 | 95 | Main component as a main component | 26 kg |
| P-854927917 | 95 | Main component as a main component | by synthesis |
| P-502403475 | 90 | Main component as a main component | in stock |
| P-611609718 | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 257.711 |
| logP | 1.9569 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 49.77 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 70.3423 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 16 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
