Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2682233624
Compound
Show structures
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 | 97 | 22 working days | Get Quote |
| 5 mg | 6 USD | 98 | 20 working days | Get Quote |
| 10 mg | 6 USD | 98 | 20 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-8853752958
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2682233624.sdf |
| SMILES | MCULE-2682233624.smiles |
| Standard InChI | MCULE-2682233624.inchi |
| InChIKey | MCULE-2682233624.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-869186764 | 95 | As is | in stock |
| P-505389334 | 99 | As is | in stock |
| P-505389685 | 98 | As is | in stock |
| P-1263079691 | N/A | As is | in stock |
| P-619176831 | 98 | As is | 500 g |
| P-864203250 | 95 | As is | in stock |
| P-901463554 | 95 | As is | by synthesis |
| P-901493794 | 95 | As is | by synthesis |
| P-893219432 | 95 | As is | in stock |
| P-870652885 | N/A | As is | in stock |
| P-505493923 | 95 | As is | in stock |
| P-524444093 | 97 | As is | 593 mg |
| P-500376399 | 98 | As is | by synthesis |
| P-617403135 | N/A | As is | in stock |
| P-869157532 | 95 | As is | by synthesis |
| P-892293737 | 95 | As is | unavailable |
| P-888653579 | 95 | As is | 175 mg |
| P-906868434 | 99 | As is | by synthesis |
| P-611475073 | 90 | As is | in stock |
| P-867565540 | 97 | As a main component | in stock |
| P-852120638 | N/A | As a main component | by synthesis |
| P-869189666 | 95 | As a main component | in stock |
| P-505354370 | 98 | As a main component | in stock |
| P-505389336 | 98 | As a main component | in stock |
| P-851943110 | N/A | As a main component | in stock |
| P-606945822 | N/A | As a main component | in stock |
| P-895111442 | 98 | As a main component | 200 g |
| P-596929072 | 97 | As a main component | 29 g |
| P-895103841 | 98 | As a main component | 400 g |
| P-580194398 | 98 | As a main component | in stock |
| P-864142291 | 95 | As a main component | in stock |
| P-889578948 | 95 | As a main component | in stock |
| P-893227544 | 95 | As a main component | in stock |
| P-580450384 | 98 | As a main component | in stock |
| P-870662565 | 98 | As a main component | in stock |
| P-870661964 | 98 | As a main component | in stock |
| P-505493959 | 95 | As a main component | in stock |
| P-488555442 | 92 | As a main component | in stock |
| P-488555262 | 90 | As a main component | in stock |
| P-524440218 | 97 | As a main component | 7.248 g |
| P-855956393 | 97 | As a main component | 100 g |
| P-31257427 | 90 | As a main component | unavailable |
| P-856016933 | 90 | As a main component | 500 mg |
| P-474026217 | 95 | As a main component | in stock |
| P-13822796 | 92 | As a main component | 300 mg |
| P-500379284 | 98 | As a main component | by synthesis |
| P-889874814 | 95 | As a main component | by synthesis |
| P-579710447 | N/A | As a main component | in stock |
| P-869108139 | 95 | As a main component | by synthesis |
| P-892286811 | 95 | As a main component | 1.002 g |
| P-888627176 | 95 | As a main component | 1.002 g |
| P-873213968 | 90 | As a main component | in stock |
| P-906904493 | 98 | As a main component | in stock |
| P-906776870 | 98 | As a main component | by synthesis |
| P-611472137 | 90 | As a main component | in stock |
| P-617773404 | 90 | As a main component | 140 mg |
| P-666979061 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 314.406 |
| logP | 2.764 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 10 |
| PSA | 111.56 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 86.0104 |
| Atoms | 43 |
| Rings | 1 |
| Heavy atoms | 21 |
| Hydrogen atoms | 22 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
