Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1027841713-0
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 | 5 USD | 98 | 20 working days | Get Quote |
| 5 mg | 5 USD | 98 | 20 working days | Get Quote |
| 10 mg | 5 USD | 98 | 20 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-4502754234-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1027841713-0.sdf |
| SMILES | MCULE-1027841713-0.smiles |
| Standard InChI | MCULE-1027841713-0.inchi |
| InChIKey | MCULE-1027841713-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867564321 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875723697 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869181967 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-874600628 | AK Scientific | Building Blocks | 90 | As is | in stock |
| P-505348439 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-580198496 | Aldlab Chemicals | Building Block Stock | 95 | As is | 15 g |
| P-617061139 | Allbio Pharm | In stock | N/A | As is | in stock |
| P-606900679 | AmBeed | In stock | N/A | As is | in stock |
| P-489148383 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596946355 | Angene | Building Blocks in stock | 98 | As is | 1000 g |
| P-552048492 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864183076 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-481171583 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 18.375 kg |
| P-580724916 | BLD pharm | In-stock building blocks | 97 | As is | 2.85 kg |
| P-893254843 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-878239878 | CHESS Chem | All products | 98 | As is | in stock |
| P-851257097 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868554503 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580406466 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-896531396 | FluoroChem | In Stock BB | 97 | As is | 300 g |
| P-870655794 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-590341420 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 15 g |
| P-890218974 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-505507564 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-504609020 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-488548028 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13745266 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-454401271 | Key Organics | Building Blocks | 97 | As is | 1.002 g |
| P-454318457 | Key Organics | Screening Compounds and Fragments | 97 | As is | 1.002 g |
| P-579611310 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-31161156 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-856040556 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-613284841 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-580510765 | Manchester Organics | Stock compounds | 98 | As is | 1.97 kg |
| P-852444387 | Matrix Scientific | All | N/A | As is | in stock |
| P-428093757 | Maybridge | Screening Collection | 95 | As is | 500 g |
| P-855402166 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-26433803 | Otava | In-House Stock Library | 90 | As is | 4 g |
| P-492280052 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As is | 4 g |
| P-888900942 | PharmaBlock | In stock | N/A | As is | in stock |
| P-454367190 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-500399243 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-19346628 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-859995238 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-498720884 | Synthonix | In-stock Building Blocks | 95 | As is | 54.185 kg |
| P-502329400 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-3248761 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 25.965 g |
| P-25154969 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 25.965 g |
| P-3225009 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 25.965 g |
| P-893945760 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-867546236 | A2B Chem | Predominantly Building Block in stock | 97 | As a main component | in stock |
| P-875702672 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
| P-881672596 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-505396282 | AK Scientific | Building Blocks | 98 | As a main component | in stock |
| P-851941463 | AmBeed | In stock | N/A | As a main component | in stock |
| P-489194491 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a main component | in stock |
| P-596939604 | Angene | Building Blocks in stock | 98 | As a main component | 9.5 kg |
| P-864137323 | AstaTech | In Stock BBs | 95 | As a main component | in stock |
| P-580700503 | BLD pharm | In-stock building blocks | 97 | As a main component | 625 g |
| P-851300602 | Chemshuttle | On request catalog | 95 | As a main component | by synthesis |
| P-868583969 | Combi-Blocks | Building Block in stock | 98 | As a main component | in stock |
| P-580296606 | Debye Scientific | General Catalog | 95 | As a main component | by resynthesis (? - ? days) |
| P-861953154 | FluoroChem | General BB | 95 | As a main component | in stock |
| P-524167962 | Key Organics | Building Blocks | 98 | As a main component | 100 g |
| P-855993182 | Key Organics | Screening Compounds and Fragments | 98 | As a main component | 100 mg |
| P-854750962 | MedChemExpress | In stock Building Blocks | 95 | As a main component | in stock |
| P-498690979 | Synthonix | In-stock Building Blocks | 95 | As a main component | unavailable |
| P-611457417 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-893995601 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 157.210 |
| logP | 0.8779 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 38.33 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 46.4577 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 15 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
