Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7156684879
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 | 90 | 14 working days | Get Quote |
| 5 mg | 28 USD | 90 | 14 working days | Get Quote |
| 10 mg | 39 USD | 90 | 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-7156684879.sdf |
| SMILES | MCULE-7156684879.smiles |
| Standard InChI | MCULE-7156684879.inchi |
| InChIKey | MCULE-7156684879.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867318123 | N/A | As is | by synthesis |
| P-904539830 | 95 | As is | in stock |
| P-893260379 | 95 | As is | by synthesis |
| P-577181390 | 90 | As is | by synthesis |
| P-870130112 | 90 | As is | 88 mg |
| P-888179777 | 90 | As is | in stock |
| P-579804478 | 90 | As is | in stock |
| P-580089648 | 95 | As is | 11.99 g |
| P-502980013 | 90 | As is | in stock |
| P-870580279 | 95 | As is | in stock |
| P-488544922 | 90 | As is | in stock |
| P-14015160 | 95 | As is | 300 mg |
| P-18818686 | 90 | As is | 94 mg |
| P-864045487 | 95 | As is | by synthesis |
| P-579724275 | 90 | As is | in stock |
| P-579725488 | 90 | As is | in stock |
| P-26440065 | 90 | As is | 11.99 g |
| P-617693656 | 95 | As is | 11.99 g |
| P-454364326 | 92 | As is | in stock |
| P-590242299 | 92 | As is | 300 mg |
| P-856067583 | 95 | As is | in stock |
| P-424851815 | 90 | As is | in stock |
| P-502370229 | 90 | As is | in stock |
| P-903966183 | 94 | As is | by resynthesis (? - ? days) |
| P-3133115 | 90 | As is | 119 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 225.245 |
| logP | 2.4025 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 54.02 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 70.9549 |
| Atoms | 28 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 11 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
