Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3940134013
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 22 USD | 98 | 20 working days | Get Quote |
| 10 mg | 22 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.
| Name | File |
|---|---|
| SDF | MCULE-3940134013.sdf |
| SMILES | MCULE-3940134013.smiles |
| Standard InChI | MCULE-3940134013.inchi |
| InChIKey | MCULE-3940134013.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867644408 | 95 | As is | in stock |
| P-875811477 | N/A | As is | in stock |
| P-615712406 | 98 | As is | in stock |
| P-903171934 | 98 | As is | 10 g |
| P-893586373 | 90 | As is | 47.5 g |
| P-606887793 | N/A | As is | in stock |
| P-865923422 | 98 | As is | 10 g |
| P-889579411 | 95 | As is | in stock |
| P-492259612 | 95 | As is | in stock |
| P-454734792 | 90 | As is | in stock |
| P-505608097 | 95 | As is | by synthesis |
| P-436473946 | 95 | As is | in stock |
| P-851291525 | 95 | As is | by synthesis |
| P-861532171 | 95 | As is | by synthesis |
| P-862041866 | 95 | As is | 14.5 g |
| P-492225491 | 95 | As is | in stock |
| P-488554175 | 90 | As is | in stock |
| P-24471112 | 95 | As is | 300 mg |
| P-500164702 | 96 | As is | in stock |
| P-596596424 | 90 | As is | 5 g |
| P-613334583 | 95 | As is | by synthesis |
| P-580463622 | 97 | As is | by synthesis |
| P-852533820 | N/A | As is | in stock |
| P-854939433 | 95 | As is | by synthesis |
| P-888886460 | N/A | As is | in stock |
| P-454374718 | 92 | As is | in stock |
| P-445305152 | 92 | As is | 300 mg |
| P-885518913 | 95 | As is | by synthesis |
| P-19649867 | 90 | As is | in stock |
| P-904100361 | 95 | As is | 8 g |
| P-23214486 | 90 | As is | in stock |
| P-502374608 | 90 | As is | in stock |
| P-889682349 | 90 | As is | 49 mg |
| P-611437740 | 90 | As is | in stock |
| P-464687368 | 90 | As is | 1000 mg |
| P-24772713 | 90 | As is | 1000 mg |
| P-893978988 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 148.162 |
| logP | 1.27028 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 45.91 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 40.41 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 8 |
| 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 |
