Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4850770365
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 | 16 USD | 98 | 11 working days | Get Quote |
| 5 mg | 16 USD | 98 | 11 working days | Get Quote |
| 10 mg | 16 USD | 98 | 11 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-5599039850
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4850770365.sdf |
| SMILES | MCULE-4850770365.smiles |
| Standard InChI | MCULE-4850770365.inchi |
| InChIKey | MCULE-4850770365.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867640732 | 98 | As is | in stock |
| P-875807162 | N/A | As is | in stock |
| P-612942662 | 97 | As is | in stock |
| P-903164971 | 97 | As is | 5 g |
| P-893513241 | 90 | As is | 52.8 g |
| P-851801416 | N/A | As is | by synthesis |
| P-489202135 | 97 | As is | in stock |
| P-873295846 | 97 | As is | 25 g |
| P-895931549 | 95 | As is | by resynthesis (? - ? days) |
| P-889585261 | 95 | As is | in stock |
| P-591095251 | 95 | As is | by synthesis |
| P-492250537 | 95 | As is | in stock |
| P-454759205 | 90 | As is | in stock |
| P-454718174 | 90 | As is | in stock |
| P-619847420 | 90 | As is | 72 mg |
| P-436456376 | 95 | As is | 10 g |
| P-34856383 | 90 | As is | in stock |
| P-868642468 | 98 | As is | in stock |
| P-278316736 | 90 | As is | by synthesis |
| P-580778836 | 90 | As is | by resynthesis (? - ? days) |
| P-580768047 | 90 | As is | in stock |
| P-861969860 | 97 | As is | 25 g |
| P-502495620 | 95 | As is | by synthesis |
| P-454314140 | 95 | As is | 226 mg |
| P-454399728 | 95 | As is | 25 g |
| P-14064184 | 95 | As is | 58 mg |
| P-601072730 | 90 | As is | 58 mg |
| P-852390245 | N/A | As is | in stock |
| P-895303491 | 95 | As is | by synthesis |
| P-491131370 | 95 | As is | by synthesis |
| P-424836297 | 90 | As is | in stock |
| P-33467268 | 90 | As is | in stock |
| P-502344436 | 90 | As is | in stock |
| P-888480125 | 94 | As is | by resynthesis (? - ? days) |
| P-611376956 | 90 | As is | in stock |
| P-596527409 | 90 | As is | 1.05 g |
| P-35121328 | 90 | As is | 1.05 g |
| P-872760373 | 95 | As is | in stock |
| P-886667590 | 95 | As a main component | in stock |
| P-889970153 | N/A | As a main component | by synthesis |
| P-894655689 | 95 | As a main component | in stock |
| P-903233343 | 95 | As a main component | 1000 mg |
| P-851757392 | N/A | As a main component | by synthesis |
| P-611199449 | 95 | As a main component | by synthesis |
| P-861387241 | 95 | As a main component | by synthesis |
| P-854897583 | 95 | As a main component | by synthesis |
| P-855224159 | 90 | As a main component | in stock |
| P-893800165 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 219.665 |
| logP | 4.2957 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 35.25 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 62.3724 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 10 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
