Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3651347833
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 | 15 working days | Get Quote |
| 5 mg | 30 USD | 98 | 16 working days | Get Quote |
| 10 mg | 52 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-9636727808
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3651347833.sdf |
| SMILES | MCULE-3651347833.smiles |
| Standard InChI | MCULE-3651347833.inchi |
| InChIKey | MCULE-3651347833.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875707038 | N/A | As is | in stock |
| P-590361670 | 98 | As is | in stock |
| P-505394379 | 98 | As is | in stock |
| P-903031938 | 98 | As is | 50 mg |
| P-893472610 | 90 | As is | 4.819 g |
| P-606915956 | N/A | As is | in stock |
| P-619201022 | 98 | As is | 50 mg |
| P-872726864 | 98 | As is | in stock |
| P-864123423 | 95 | As is | in stock |
| P-860056760 | 98 | As is | by synthesis |
| P-868544878 | 98 | As is | in stock |
| P-580719162 | 98 | As is | 142 mg |
| P-893238684 | 95 | As is | in stock |
| P-851260416 | 95 | As is | by synthesis |
| P-860799371 | 98 | As is | in stock |
| P-861492028 | 95 | As is | by synthesis |
| P-579479578 | 95 | As is | in stock |
| P-868078746 | 95 | As is | in stock |
| P-524166585 | 98 | As is | 100 mg |
| P-852531234 | N/A | As is | in stock |
| P-854717969 | 95 | As is | in stock |
| P-474027712 | 95 | As is | in stock |
| P-608272592 | 98 | As is | in stock |
| P-579712526 | N/A | As is | in stock |
| P-589631509 | N/A | As is | in stock |
| P-869122966 | 95 | As is | by synthesis |
| P-892290067 | 95 | As is | unavailable |
| P-888637211 | 95 | As is | 68 mg |
| P-575297073 | 95 | As is | in stock |
| P-612903848 | 99 | As a main component | by synthesis |
| P-894643236 | 95 | As a main component | in stock |
| P-851865659 | N/A | As a main component | by synthesis |
| P-489223161 | 97 | As a main component | in stock |
| P-1263076063 | 99 | As a main component | in stock |
| P-591038828 | 98 | As a main component | by synthesis |
| P-901548021 | 95 | As a main component | by synthesis |
| P-608495731 | 95 | As a main component | in stock |
| P-873250311 | 97 | As a main component | 5 mg |
| P-895192645 | 95 | As a main component | by synthesis |
| P-584627062 | 95 | As a main component | in stock |
| P-888169933 | 98 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 413.556 |
| logP | 4.0011 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 10 |
| PSA | 62.75 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 129.6227 |
| Atoms | 65 |
| Rings | 4 |
| Heavy atoms | 30 |
| Hydrogen atoms | 35 |
| Heteroatoms | 7 |
| 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 |
