Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1252668991-0
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 | 24 USD | 98 | 20 working days | Get Quote |
| 5 mg | 48 USD | 98 | 20 working days | Get Quote |
| 10 mg | 79 USD | 98 | 16 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-6344881936-0
- Component type: Main
-
MCULE-5526085917-0
- Component type: Main
-
MCULE-4212885784-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1252668991-0.sdf |
| SMILES | MCULE-1252668991-0.smiles |
| Standard InChI | MCULE-1252668991-0.inchi |
| InChIKey | MCULE-1252668991-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867552554 | 98 | As is | in stock |
| P-875711122 | N/A | As is | in stock |
| P-869200854 | 95 | As is | in stock |
| P-903037348 | 98 | As is | 1.25 g |
| P-893503877 | 90 | As is | 80.695 g |
| P-606861185 | N/A | As is | in stock |
| P-865905829 | 98 | As is | 1.25 g |
| P-872725758 | 98 | As is | in stock |
| P-864150095 | 95 | As is | in stock |
| P-580726854 | 98 | As is | 1.677 g |
| P-901471834 | 95 | As is | by synthesis |
| P-851278856 | 95 | As is | by synthesis |
| P-860799883 | 98 | As is | in stock |
| P-861365434 | 95 | As is | by synthesis |
| P-675215737 | 95 | As is | in stock |
| P-868489125 | 96 | As is | in stock |
| P-855925172 | 97 | As is | 100 mg |
| P-854720592 | 95 | As is | in stock |
| P-474025114 | 95 | As is | in stock |
| P-608273207 | 98 | As is | in stock |
| P-589631544 | N/A | As is | in stock |
| P-579712918 | N/A | As is | in stock |
| P-611498636 | 90 | As is | in stock |
| P-893965815 | 95 | As is | in stock |
| P-892885048 | 98 | As a main component | in stock |
| P-867681049 | 95 | As a main component | in stock |
| P-875858008 | N/A | As a main component | in stock |
| P-890186353 | N/A | As a main component | in stock |
| P-874643456 | N/A | As a main component | in stock |
| P-869242806 | 95 | As a main component | in stock |
| P-903344448 | 98 | As a main component | 300 mg |
| P-904321305 | 90 | As a main component | 7.377 g |
| P-905021685 | N/A | As a main component | by synthesis |
| P-892193334 | 98 | As a main component | 300 mg |
| P-872727576 | 98 | As a main component | in stock |
| P-905463157 | 95 | As a main component | in stock |
| P-1263348650 | 97 | As a main component | by synthesis |
| P-901922752 | 99 | As a main component | 481 mg |
| P-901532271 | 95 | As a main component | by synthesis |
| P-579480612 | 95 | As a main component | in stock |
| P-868489127 | 96 | As a main component | in stock |
| P-873244957 | 97 | As a main component | 50 mg |
| P-895206428 | 95 | As a main component | by synthesis |
| P-854720274 | 95 | As a main component | in stock |
| P-896072025 | 95 | As a main component | in stock |
| P-869128271 | 95 | As a main component | by synthesis |
| P-888641049 | 95 | As a main component | unavailable |
| P-872762997 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 287.400 |
| logP | 3.5597 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 54.28 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 87.3251 |
| Atoms | 46 |
| Rings | 2 |
| Heavy atoms | 21 |
| Hydrogen atoms | 25 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
