Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2354296394
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 | 36 USD | 90 | 26 working days | Get Quote |
| 5 mg | 36 USD | 90 | 26 working days | Get Quote |
| 10 mg | 41 USD | 90 | 26 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-8535154703
- Component type: Unknown
-
MCULE-8774510897
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2354296394.sdf |
| SMILES | MCULE-2354296394.smiles |
| Standard InChI | MCULE-2354296394.inchi |
| InChIKey | MCULE-2354296394.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-893113993 | N/A | As is | by synthesis |
| P-892963966 | N/A | As is | by synthesis |
| P-867453362 | N/A | As is | by synthesis |
| P-489156490 | 97 | As is | in stock |
| P-901424253 | 95 | As is | by synthesis |
| P-19873093 | 90 | As is | in stock |
| P-34544876 | 90 | As is | in stock |
| P-500417102 | 99 | As is | in stock |
| P-608220012 | 99 | As is | in stock |
| P-492243317 | 95 | As is | in stock |
| P-856010183 | 90 | As is | 100 mg |
| P-31248417 | 90 | As is | 10 g |
| P-856041002 | 90 | As is | 10 g |
| P-895330612 | 95 | As is | by synthesis |
| P-621858112 | 90 | As is | by synthesis |
| P-885523163 | 95 | As is | by synthesis |
| P-424801593 | 90 | As is | in stock |
| P-899773106 | N/A | As is | unavailable |
| P-33162302 | 90 | As is | 70 mg |
| P-906904193 | 99 | As is | in stock |
| P-3224533 | 90 | As is | 18.61 g |
| P-423129 | 90 | As is | 18.61 g |
| P-500418069 | 98 | As a main component | in stock |
| P-500418070 | 99 | As a main component | in stock |
| P-622581697 | 90 | As a main component | by synthesis |
| P-885560606 | 95 | As a main component | by synthesis |
| P-906759453 | 99 | As a main component | by synthesis |
| P-906875185 | 99 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 176.124 |
| logP | -1.4074 |
| H-bond acceptors | 6 |
| H-bond donors | 4 |
| Rotatable bonds | 2 |
| PSA | 107.22 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 35.1202 |
| Atoms | 20 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 8 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
