Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7246728993
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 | 5 USD | 95 | 14 working days | Get Quote |
| 5 mg | 5 USD | 95 | 14 working days | Get Quote |
| 10 mg | 5 USD | 95 | 14 working days | Get Quote |
- 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.
| Name | File |
|---|---|
| SDF | MCULE-7246728993.sdf |
| SMILES | MCULE-7246728993.smiles |
| Standard InChI | MCULE-7246728993.inchi |
| InChIKey | MCULE-7246728993.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867572114 | 95 | As is | in stock |
| P-875732835 | 97 | As is | in stock |
| P-1275188256 | 98 | As is | in stock |
| P-1275156180 | 95 | As is | in stock |
| P-903062985 | 95 | As is | 700 g |
| P-617066762 | 95 | As is | in stock |
| P-606895525 | N/A | As is | in stock |
| P-489173737 | 97 | As is | in stock |
| P-596950139 | 95 | As is | 4.6 kg |
| P-1275497044 | 95 | As is | 150 g |
| P-1273455267 | 95 | As is | by resynthesis (? - ? days) |
| P-864110747 | 95 | As is | in stock |
| P-893223315 | 95 | As is | in stock |
| P-851260491 | 95 | As is | by synthesis |
| P-868646404 | 97 | As is | in stock |
| P-580424555 | 95 | As is | by resynthesis (? - ? days) |
| P-862071812 | 95 | As is | 13.6673 kg |
| P-905350536 | 95 | As is | 25 g |
| P-505493546 | 95 | As is | in stock |
| P-524199736 | 95 | As is | 25 g |
| P-855997387 | 95 | As is | 100 mg |
| P-579616502 | 95 | As is | in stock |
| P-854692231 | 95 | As is | in stock |
| P-899988908 | 95 | As is | by synthesis |
| P-500403506 | 98 | As is | by synthesis |
| P-889862413 | 95 | As is | by synthesis |
| P-596754402 | 95 | As is | 524.9 g |
| P-892303289 | 95 | As is | in stock |
| P-869159193 | 95 | As is | 2.547 g |
| P-892294028 | 95 | As is | 2.547 g |
| P-888654810 | 95 | As is | 2.547 g |
| P-906774221 | 95 | As is | by synthesis |
| P-611370971 | 90 | As is | in stock |
| P-580071565 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 126.110 |
| logP | 0.8034 |
| H-bond acceptors | 3 |
| H-bond donors | 3 |
| Rotatable bonds | 0 |
| PSA | 60.69 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 32.511 |
| Atoms | 15 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 6 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
