Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3862545934
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 | 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.
| Name | File |
|---|---|
| SDF | MCULE-3862545934.sdf |
| SMILES | MCULE-3862545934.smiles |
| Standard InChI | MCULE-3862545934.inchi |
| InChIKey | MCULE-3862545934.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-866098377 | Advanced Chemical Intermediates (ACI) | ACI predominantly BB catalog | 95 | As is | 500 g |
| P-580198269 | Aldlab Chemicals | Building Block Stock | 95 | As is | 150 g |
| P-489186189 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-864090374 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-481174996 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 10.75 g |
| P-505573138 | Bosche Scientific | Bosche Products | 98 | As is | in stock |
| P-878239823 | CHESS Chem | All products | 98 | As is | in stock |
| P-874550355 | ChemDiv | Discovery Chemistry Library | 90 | As is | in stock |
| P-580406618 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-579720500 | EDASA Scientific Limited | Synthesis Building Blocks | N/A | As is | by resynthesis (? - ? days) |
| P-889111439 | FluoroChem | In Stock BB | 98 | As is | 15.227 kg |
| P-494300666 | Frinton Laboratories | Frinton Building Blocks | 98 | As is | in stock |
| P-870646691 | Glentham Life Sciences | Compounds typically in stock | 98 | As is | in stock |
| P-873257740 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 5 g |
| P-505494497 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-488554391 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-24481012 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-500157790 | J&W Pharmlab | In-stock compounds | 97 | As is | in stock |
| P-454377998 | Key Organics | Building Blocks | 95 | As is | 89.789 g |
| P-18794003 | Key Organics | Screening Compounds and Fragments | 95 | As is | 89.789 g |
| P-615637943 | LabNetwork | In stock | 95 | As is | in stock |
| P-31161075 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-500222560 | LeadGen Labs | In-stock compounds | 98 | As is | in stock |
| P-613283766 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-580510418 | Manchester Organics | Stock compounds | 97 | As is | 417 g |
| P-852427501 | Matrix Scientific | All | N/A | As is | in stock |
| P-35290214 | Maybridge | Screening Collection | 90 | As is | 4.424 kg |
| P-12465796 | Otava | In-House Stock Library | 90 | As is | 315 mg |
| P-617689815 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 315 mg |
| P-888857362 | PharmaBlock | In stock | N/A | As is | in stock |
| P-454374936 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-445288648 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-500383041 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-424840257 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885528940 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-579704191 | Sinova Inc. | In-stock Building Blocks | N/A | As is | in stock |
| P-498721686 | Synthonix | In-stock Building Blocks | 97 | As is | 1.142 kg |
| P-502332755 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611411252 | Toronto Research | In stock | 90 | As is | in stock |
| P-25532812 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.21 g |
| P-464682193 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.21 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 199.247 |
| logP | 1.5243 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 46.61 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 56.793 |
| Atoms | 31 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 17 |
| 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 |
