Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1406775026
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 | 16 USD | 98 | 22 working days | Get Quote |
| 5 mg | 16 USD | 98 | 22 working days | Get Quote |
| 10 mg | 16 USD | 98 | 22 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-1406775026.sdf |
| SMILES | MCULE-1406775026.smiles |
| Standard InChI | MCULE-1406775026.inchi |
| InChIKey | MCULE-1406775026.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867565662 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875724704 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590403323 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-881038205 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580443029 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-502505420 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-488549496 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-855987361 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-856041986 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-31275033 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-613284895 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-852426834 | Matrix Scientific | All | N/A | As is | in stock |
| P-620224306 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-620069589 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-454368173 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-885515781 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-23969399 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-502368513 | TimTec | Building Block Collection | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 150.174 |
| logP | 1.4642 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 21.76 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 41.519 |
| Atoms | 21 |
| Rings | 2 |
| Heavy atoms | 11 |
| Hydrogen atoms | 10 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
