Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7110759140
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 | 39 USD | 95 | 15 working days | Get Quote |
| 5 mg | 56 USD | 95 | 27 working days | Get Quote |
| 10 mg | 56 USD | 95 | 27 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-7110759140.sdf |
| SMILES | MCULE-7110759140.smiles |
| Standard InChI | MCULE-7110759140.inchi |
| InChIKey | MCULE-7110759140.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-612863385 | 95 | As is | by synthesis |
| P-901187343 | N/A | As is | by synthesis |
| P-894655673 | 95 | As is | in stock |
| P-851524905 | N/A | As is | by synthesis |
| P-611183255 | 95 | As is | by synthesis |
| P-492268769 | 95 | As is | in stock |
| P-5052098 | 90 | As is | 25 mg |
| P-3660853 | 90 | As is | 1.395 g |
| P-425248965 | 90 | As is | in stock |
| P-861371005 | 95 | As is | by synthesis |
| P-12663470 | 95 | As is | 120 mg |
| P-855946782 | 95 | As is | 1000 mg |
| P-31187438 | 90 | As is | 30 mg |
| P-854924515 | 95 | As is | by synthesis |
| P-19123741 | 90 | As is | in stock |
| P-12861026 | 90 | As is | 33 mg |
| P-33764542 | 94 | As is | by resynthesis (? - ? days) |
| P-596710185 | 90 | As is | 7 mg |
| P-611611072 | 90 | As is | in stock |
| P-885394 | 90 | As is | 182 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 229.274 |
| logP | 3.1007 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 42.23 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 67.6263 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 15 |
| 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 |
