Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4200098374
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 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-4200098374.sdf |
| SMILES | MCULE-4200098374.smiles |
| Standard InChI | MCULE-4200098374.inchi |
| InChIKey | MCULE-4200098374.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867542172 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875698275 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869202734 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-903020774 | Aaron Chemicals LLC | Predominantly Building Block | 95 | As is | 37 g |
| P-893547976 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 6.822 g |
| P-881612568 | AmBeed | In stock | N/A | As is | in stock |
| P-865903609 | Angene | Building Blocks in stock | 95 | As is | 1000 mg |
| P-895952349 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864181784 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-890238312 | BLD pharm | In-stock building blocks | 95 | As is | 1000 mg |
| P-901515542 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-492260314 | ChemBridge | Building Block Library | 95 | As is | in stock |
| P-851259681 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-905263728 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-862042126 | FluoroChem | China Stock BB | 95 | As is | 34.484 g |
| P-13876697 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13827734 | InterBioScreen | Screening Compounds | 95 | As is | 300 mg |
| P-596597064 | Key Organics | Building Blocks | 90 | As is | 1000 mg |
| P-852530690 | Matrix Scientific | All | N/A | As is | in stock |
| P-863720108 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-888885803 | PharmaBlock | In stock | N/A | As is | in stock |
| P-454373623 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-14031503 | Pharmeks LLC | Synthetic compounds | 92 | As is | in stock |
| P-885530480 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-579440445 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-904086486 | Synthonix | In-stock Building Blocks | 97 | As is | 82.34 g |
| P-906805728 | Titan Scientific | Predominantly Building Block on demand | 98 | As is | by synthesis |
| P-611553786 | Toronto Research | In stock | 90 | As is | in stock |
| P-464689200 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1000 mg |
| P-35145695 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1000 mg |
| P-893948700 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 185.021 |
| logP | 1.65928 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 28.72 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 38.109 |
| Atoms | 14 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 5 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |
