Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4461858345
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 | 10 working days | Get Quote |
| 5 mg | 5 USD | 95 | 10 working days | Get Quote |
| 10 mg | 5 USD | 95 | 10 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-8612153381
- Component type: Unknown
-
MCULE-8307938812
- Component type: Main
-
MCULE-5615737817
- Component type: Main
-
MCULE-3433082103
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4461858345.sdf |
| SMILES | MCULE-4461858345.smiles |
| Standard InChI | MCULE-4461858345.inchi |
| InChIKey | MCULE-4461858345.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867578270 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875737647 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-535627350 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505390520 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-580197931 | Aldlab Chemicals | Building Block Stock | 95 | As is | 80 g |
| P-606862860 | AmBeed | In stock | N/A | As is | in stock |
| P-489145214 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-489125521 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596931059 | Angene | Building Blocks in stock | 99 | As is | 6.5 kg |
| P-494345721 | Apollo Scientific | In Stock | 95 | As is | unavailable |
| P-864183990 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-481169598 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 19.5 g |
| P-580707104 | BLD pharm | In-stock building blocks | 98 | As is | 2.295 kg |
| P-893238328 | Biosynth | In Stock | 95 | As is | in stock |
| P-505575906 | Bosche Scientific | Bosche Products | 99 | As is | in stock |
| P-851280081 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868571989 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580401748 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-500235610 | Diverchim | Diverchim General Catalog | N/A | As is | in stock |
| P-861919574 | FluoroChem | General BB | 99 | As is | in stock |
| P-600955573 | Georganics Ltd. | In stock | 98 | As is | in stock |
| P-870655150 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-890206220 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-579489102 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 15 g |
| P-505491198 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-492217487 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-454384876 | Key Organics | Building Blocks | 95 | As is | 26 g |
| P-454284883 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-856042010 | LaboTest | Building Blocks | 90 | As is | unavailable |
| P-31226525 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-579754809 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-601066179 | Life Chemicals | Screening Compounds | 90 | As is | 51 mg |
| P-852443484 | Matrix Scientific | All | N/A | As is | in stock |
| P-428012135 | Maybridge | Screening Collection | 95 | As is | 882 g |
| P-854722945 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-492278047 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As is | 694 mg |
| P-12472234 | Otava | In-House Stock Library | 90 | As is | 694 mg |
| P-888884831 | PharmaBlock | In stock | N/A | As is | in stock |
| P-519855921 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885544715 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-899773151 | Specs | Repurposed Compounds | N/A | As is | 34.707 g |
| P-596792471 | Synthonix | In-stock Building Blocks | 95 | As is | 23.1065 kg |
| P-502329618 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22521493 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
| P-615391743 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-875717959 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-590403375 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-606856977 | AmBeed | In stock | N/A | As a main component | in stock |
| P-489125556 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a main component | in stock |
| P-596944234 | Angene | Building Blocks in stock | 98 | As a main component | 1.5 kg |
| P-494335505 | Apollo Scientific | On request | 95 | As a main component | by resynthesis (? - ? days) |
| P-864138295 | AstaTech | In Stock BBs | 95 | As a main component | in stock |
| P-590609577 | BLD pharm | In-stock building blocks | 95 | As a main component | 30 g |
| P-870586412 | Combi-Blocks | Building Block in stock | 98 | As a main component | in stock |
| P-862030652 | FluoroChem | General BB | 95 | As a main component | in stock |
| P-504021671 | Innovapharm | Virtual Screening Compounds | 90 | As a main component | by synthesis |
| P-504022069 | Innovapharm | Virtual Screening Compounds | 90 | As a main component | by synthesis |
| P-504022479 | Innovapharm | Virtual Screening Compounds | 90 | As a main component | by synthesis |
| P-454404510 | Key Organics | Building Blocks | 95 | As a main component | 25 g |
| P-852466717 | Matrix Scientific | All | N/A | As a main component | in stock |
| P-874448557 | MedChemExpress | Building Blocks in stock | 95 | As a main component | in stock |
| P-500372747 | Pi Chemicals | Virtual Compounds | 98 | As a main component | by synthesis |
| P-855314872 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-666973786 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 128.151 |
| logP | 1.4463 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 65.54 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 31.2783 |
| Atoms | 12 |
| Rings | 1 |
| Heavy atoms | 8 |
| Hydrogen atoms | 4 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |
