Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5031397425
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 | 5 USD | 95 | 22 working days | Get Quote |
| 5 mg | 5 USD | 95 | 22 working days | Get Quote |
| 10 mg | 5 USD | 95 | 22 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.
| Name | File |
|---|---|
| SDF | MCULE-5031397425.sdf |
| SMILES | MCULE-5031397425.smiles |
| Standard InChI | MCULE-5031397425.inchi |
| InChIKey | MCULE-5031397425.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867569715 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875729688 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-505401885 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-853440291 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-893505669 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 152.1 g |
| P-606950243 | AmBeed | In stock | N/A | As is | in stock |
| P-489114113 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596948892 | Angene | Building Blocks in stock | 98 | As is | 150 g |
| P-580195777 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-864136789 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-860056047 | AvaChem Scientific | On demand | 95 | As is | by synthesis |
| P-590606587 | BLD pharm | In-stock building blocks | 95 | As is | 11.5 g |
| P-871221864 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
| P-893227344 | Biosynth | In Stock | 95 | As is | in stock |
| P-851317847 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861282976 | Chiralstar | Chiralstar Building Blocks | 97 | As is | in stock |
| P-580452000 | CliniSciences S.A.S | All products | 98 | As is | in stock |
| P-579481665 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-861971545 | FluoroChem | General BB | 95 | As is | in stock |
| P-870652383 | Glentham Life Sciences | Compounds typically in stock | 98 | As is | in stock |
| P-524442740 | Key Organics | Biochemicals | 97 | As is | 480 mg |
| P-615653400 | LabNetwork | In stock | 95 | As is | in stock |
| P-854714188 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-896628282 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-474022958 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-608275080 | Molnova | Stock | 98 | As is | in stock |
| P-555283241 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-885538638 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-579711974 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-869107603 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892286213 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888626639 | TargetMol | Screening Compounds - stock amount | 95 | As is | 144 mg |
| P-611438536 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 230.672 |
| logP | 2.527 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 66.91 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 61.6837 |
| Atoms | 21 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 7 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| 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 |
