Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2947786738-0
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 | 6 USD | 97 | 14 working days | Get Quote |
| 5 mg | 6 USD | 97 | 14 working days | Get Quote |
| 10 mg | 6 USD | 97 | 14 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.
| Name | File |
|---|---|
| SDF | MCULE-2947786738-0.sdf |
| SMILES | MCULE-2947786738-0.smiles |
| Standard InChI | MCULE-2947786738-0.inchi |
| InChIKey | MCULE-2947786738-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867576454 | 97 | As is | in stock |
| P-875736970 | N/A | As is | in stock |
| P-869184060 | 95 | As is | in stock |
| P-505397890 | 98 | As is | in stock |
| P-903066759 | 97 | As is | 25 g |
| P-893334909 | 95 | As is | by synthesis |
| P-893334910 | 95 | As is | by synthesis |
| P-606932307 | N/A | As is | in stock |
| P-489120406 | 97 | As is | in stock |
| P-596951410 | 98 | As is | 2.5 kg |
| P-494320437 | 95 | As is | 63.1 g |
| P-864097571 | 95 | As is | in stock |
| P-580696760 | 97 | As is | 246 g |
| P-893229706 | 95 | As is | in stock |
| P-619926808 | 90 | As is | by synthesis |
| P-868642289 | 97 | As is | in stock |
| P-580292051 | N/A | As is | by resynthesis (? - ? days) |
| P-905328564 | 97 | As is | 489 g |
| P-861922277 | 97 | As is | 489 g |
| P-505518928 | 95 | As is | in stock |
| P-454330822 | 90 | As is | 100 mg |
| P-608097716 | 98 | As is | 100 g |
| P-31252940 | 90 | As is | unavailable |
| P-580511478 | 97 | As is | 84.8 g |
| P-852376900 | N/A | As is | in stock |
| P-854736290 | 95 | As is | in stock |
| P-888893197 | N/A | As is | in stock |
| P-500401192 | 98 | As is | by synthesis |
| P-885548650 | 95 | As is | by synthesis |
| P-596771526 | 95 | As is | 782 g |
| P-502371467 | 90 | As is | in stock |
| P-906780188 | 98 | As is | by synthesis |
| P-906776993 | 98 | As is | by synthesis |
| P-611373007 | 90 | As is | in stock |
| P-893942873 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 192.110 |
| logP | 2.657 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 17.07 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 36.7895 |
| Atoms | 17 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 4 |
| Heteroatoms | 5 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| 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 |
