Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7170650231-0
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 |
- 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-7170650231-0.sdf |
| SMILES | MCULE-7170650231-0.smiles |
| Standard InChI | MCULE-7170650231-0.inchi |
| InChIKey | MCULE-7170650231-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867557920 | 97 | As is | in stock |
| P-875717285 | 97 | As is | in stock |
| P-1275162255 | 98 | As is | in stock |
| P-1275157303 | 95 | As is | in stock |
| P-903045655 | 97 | As is | 100 g |
| P-893525890 | 90 | As is | 75.125 g |
| P-1270392766 | 97 | As is | in stock |
| P-875894001 | 95 | As is | in stock |
| P-606885316 | N/A | As is | in stock |
| P-597007206 | 98 | As is | 25 g |
| P-589654380 | 95 | As is | 4 g |
| P-864116407 | 95 | As is | in stock |
| P-492255234 | 95 | As is | in stock |
| P-4149370 | 90 | As is | 100 mg |
| P-851206048 | 95 | As is | in stock |
| P-851284186 | 95 | As is | by synthesis |
| P-868580265 | 97 | As is | in stock |
| P-580396203 | N/A | As is | by resynthesis (? - ? days) |
| P-905347872 | 95 | As is | 18 g |
| P-862040550 | 95 | As is | 40.125 g |
| P-454283838 | 90 | As is | 107 mg |
| P-1267084037 | 95 | As is | 4.08 g |
| P-468070601 | 95 | As is | 185 mg |
| P-25838666 | 90 | As is | 185 mg |
| P-872930159 | N/A | As is | by synthesis |
| P-1272596238 | 95 | As is | 25 g |
| P-852509819 | 95 | As is | by synthesis |
| P-863695137 | 95 | As is | in stock |
| P-889862993 | 95 | As is | by synthesis |
| P-873282855 | N/A | As is | in stock |
| P-22891330 | 90 | As is | in stock |
| P-903669411 | 94 | As is | by resynthesis (? - ? days) |
| P-906768640 | 98 | As is | by synthesis |
| P-611568492 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 156.184 |
| logP | 2.04998 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 28.72 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 47.915 |
| Atoms | 20 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 8 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
