Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6469555381
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 | 27 USD | N/A | 9 working days | Get Quote |
| 5 mg | 43 USD | 98 | 16 working days | Get Quote |
| 10 mg | 94 USD | 98 | 15 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-9540964187
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6469555381.sdf |
| SMILES | MCULE-6469555381.smiles |
| Standard InChI | MCULE-6469555381.inchi |
| InChIKey | MCULE-6469555381.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867648822 | 98 | As is | in stock |
| P-875816769 | N/A | As is | in stock |
| P-505399657 | 98 | As is | in stock |
| P-903179902 | 98 | As is | 500 mg |
| P-1264047223 | 95 | As is | in stock |
| P-893606932 | 90 | As is | 16.425 g |
| P-888731085 | N/A | As is | in stock |
| P-873296683 | 98 | As is | 20 mg |
| P-580193131 | 98 | As is | in stock |
| P-889772158 | 97 | As is | in stock |
| P-890242262 | 98 | As is | 15 mg |
| P-901464484 | 95 | As is | by synthesis |
| P-851242895 | 95 | As is | by synthesis |
| P-860797584 | 98 | As is | in stock |
| P-893635239 | 95 | As is | by synthesis |
| P-608498668 | 95 | As is | in stock |
| P-580271700 | 95 | As is | by resynthesis (? - ? days) |
| P-675216014 | 95 | As is | in stock |
| P-500156030 | 96 | As is | in stock |
| P-524169151 | 98 | As is | 50 mg |
| P-579674307 | 95 | As is | by resynthesis (? - ? days) |
| P-852520966 | N/A | As is | in stock |
| P-854712262 | 95 | As is | in stock |
| P-474027073 | 95 | As is | in stock |
| P-608277897 | 98 | As is | in stock |
| P-589631390 | N/A | As is | in stock |
| P-579711190 | N/A | As is | in stock |
| P-611460464 | 90 | As is | in stock |
| P-893934158 | 95 | As is | in stock |
| P-895219359 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 504.645 |
| logP | 6.0271 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 103.54 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 148.5969 |
| Atoms | 68 |
| Rings | 5 |
| Heavy atoms | 36 |
| Hydrogen atoms | 32 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| 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 |
