Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1851935542
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 | 7 USD | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 7 USD | 98 | 14 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-1851935542.sdf |
| SMILES | MCULE-1851935542.smiles |
| Standard InChI | MCULE-1851935542.inchi |
| InChIKey | MCULE-1851935542.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867588628 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-875747352 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869191401 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-590398112 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-903078036 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 3 kg |
| P-606833186 | AmBeed | In stock | N/A | As is | in stock |
| P-596955214 | Angene | Building Blocks in stock | 98 | As is | 3 kg |
| P-895936704 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864123566 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-584630378 | BLD pharm | In-stock building blocks | 98 | As is | 35 g |
| P-34884320 | Chemical Intelligence Co Limited | Stock Screening Compounds | 90 | As is | in stock |
| P-851319069 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868592588 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580276733 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889110280 | FluoroChem | In Stock BB | N/A | As is | 443.5 g |
| P-870655514 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-502528382 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-503871614 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-454354324 | Key Organics | Screening Compounds and Fragments | 90 | As is | 100 mg |
| P-579625754 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-31179498 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-580513827 | Manchester Organics | Stock compounds | 98 | As is | 169 g |
| P-852377230 | Matrix Scientific | All | N/A | As is | in stock |
| P-854766588 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-500394234 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-885542603 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596771277 | Synthonix | In-stock Building Blocks | 98 | As is | 760 g |
| P-502392070 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22522307 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 70 mg |
| P-854647789 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 153.153 |
| logP | 1.8571 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 29.1 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 40.7127 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 8 |
| 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 |
