Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1650738830-0
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 | 5 USD | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 USD | 98 | 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.
-
1
MCULE-9291274381-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1650738830-0.sdf |
| SMILES | MCULE-1650738830-0.smiles |
| Standard InChI | MCULE-1650738830-0.inchi |
| InChIKey | MCULE-1650738830-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-852201676 | N/A | As is | by synthesis |
| P-853426697 | 98 | As is | in stock |
| P-851477469 | N/A | As is | by synthesis |
| P-489135339 | 97 | As is | in stock |
| P-590815095 | 97 | As is | by synthesis |
| P-851291749 | 95 | As is | by synthesis |
| P-869025495 | 95 | As is | by synthesis |
| P-867579083 | 98 | Main component | in stock |
| P-875738578 | N/A | Main component | in stock |
| P-597023913 | 98 | Main component | in stock |
| P-535625926 | 95 | Main component | in stock |
| P-505351836 | 98 | Main component | in stock |
| P-903068585 | 98 | Main component | 425 g |
| P-907307648 | 95 | Main component | 49 g |
| P-901164728 | 98 | Main component | in stock |
| P-580199575 | 95 | Main component | 2 g |
| P-606851704 | N/A | Main component | in stock |
| P-596951946 | 98 | Main component | 1.5 kg |
| P-494350863 | 95 | Main component | 110 g |
| P-864095749 | 98 | Main component | in stock |
| P-580734692 | 98 | Main component | 722 g |
| P-901450887 | 95 | Main component | by synthesis |
| P-22006209 | 90 | Main component | 2 mg |
| P-505605543 | 97 | Main component | by synthesis |
| P-131826 | 90 | Main component | 157 mg |
| P-851239953 | 95 | Main component | by synthesis |
| P-868590026 | 98 | Main component | in stock |
| P-34678061 | 90 | Main component | by synthesis |
| P-580405453 | 95 | Main component | by resynthesis (? - ? days) |
| P-861983554 | 98 | Main component | 283.5 g |
| P-905335499 | 98 | Main component | 283.5 g |
| P-505495806 | 95 | Main component | in stock |
| P-502453498 | 95 | Main component | by synthesis |
| P-454296375 | 95 | Main component | 100 mg |
| P-454391267 | 95 | Main component | 100 g |
| P-579612508 | 98 | Main component | 500 g |
| P-31258608 | 90 | Main component | 500 mg |
| P-855386799 | 95 | Main component | by synthesis |
| P-580513315 | 97 | Main component | 60 g |
| P-852383117 | N/A | Main component | in stock |
| P-888858932 | N/A | Main component | in stock |
| P-500400759 | 98 | Main component | by synthesis |
| P-885516433 | 95 | Main component | by synthesis |
| P-24031043 | 90 | Main component | in stock |
| P-896073222 | N/A | Main component | 13.967 g |
| P-498660017 | 98 | Main component | 1.282 kg |
| P-33453606 | 90 | Main component | in stock |
| P-502330282 | 90 | Main component | in stock |
| P-611368098 | 90 | Main component | in stock |
| P-2127465 | 90 | Main component | 110 mg |
| P-615394434 | 95 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 209.470 |
| logP | 2.8095 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 38.91 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 43.3064 |
| Atoms | 15 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 6 |
| Heteroatoms | 4 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
