Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1614530570
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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 50 USD | 90 | 19 working days | Get Quote |
| 10 mg | 114 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-1614530570.sdf |
| SMILES | MCULE-1614530570.smiles |
| Standard InChI | MCULE-1614530570.inchi |
| InChIKey | MCULE-1614530570.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886649142 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875833024 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-595216607 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851486592 | AmBeed | On request | N/A | As is | by synthesis |
| P-489199869 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-494340608 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-590814115 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-861485716 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580413914 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-12763460 | InterBioScreen | Screening Compounds | 92 | As is | unavailable |
| P-454411430 | Key Organics | Building Blocks | 95 | As is | 558 mg |
| P-454341962 | Key Organics | Screening Compounds and Fragments | 95 | As is | 558 mg |
| P-579671003 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-852470958 | Matrix Scientific | All | N/A | As is | in stock |
| P-854865071 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-605214758 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-596710626 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 5 mg |
| P-611592191 | Toronto Research | In stock | 90 | As is | in stock |
| P-24817468 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 9 mg |
| P-893678216 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 198.224 |
| logP | 1.96648 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 67.63 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 57.0954 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 10 |
| 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 |
