Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7157392758
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-8619425606
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7157392758.sdf |
| SMILES | MCULE-7157392758.smiles |
| Standard InChI | MCULE-7157392758.inchi |
| InChIKey | MCULE-7157392758.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875760966 | N/A | As is | in stock |
| P-903097593 | 95 | As is | 10 mg |
| P-895095674 | 95 | As is | 10 mg |
| P-872728539 | 98 | As is | in stock |
| P-893258409 | 95 | As is | by synthesis |
| P-449700004 | 90 | As is | 359 mg |
| P-578527362 | 90 | As is | in stock |
| P-517096651 | 90 | As is | in stock |
| P-870653965 | N/A | As is | in stock |
| P-524164699 | 98 | As is | 1000 g |
| P-873246000 | 95 | As is | 1 mg |
| P-856005881 | 98 | As is | 100 mg |
| P-885540845 | 95 | As is | by synthesis |
| P-888578410 | 94 | As is | by resynthesis (? - ? days) |
| P-906779573 | 98 | As is | by synthesis |
| P-596567185 | 95 | As a main component | 25 g |
| P-906755632 | 90 | As a main component | by synthesis |
| P-906879089 | 98 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 392.571 |
| logP | 4.4779 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 4 |
| PSA | 77.76 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 112.6014 |
| Atoms | 68 |
| Rings | 4 |
| Heavy atoms | 28 |
| Hydrogen atoms | 40 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 10 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 10 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
