MCULE-2613657945
- 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.
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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.
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1 mg | 159 USD | 95 | 11 working days | Get Quote |
5 mg | 448 USD | 98 | 16 working days | Get Quote |
10 mg | 678 USD | 98 | 16 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-2613657945.sdf |
SMILES | MCULE-2613657945.smiles |
Standard InChI | MCULE-2613657945.inchi |
InChIKey | MCULE-2613657945.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-591065369 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
P-851307401 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-868658804 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
P-854720934 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
P-878645108 | Molnova | Stock | 98 | As is | in stock |
P-867637457 | A2B Chem | Predominantly Building Block in stock | 99 | As an isomer | in stock |
P-851753893 | AmBeed | On request | N/A | As an isomer | by synthesis |
P-865921279 | Angene | Building Blocks in stock | 99 | As an isomer | 20 mg |
P-889521078 | AstaTech | Backordered BBs | 95 | As an isomer | by synthesis |
P-868079205 | Hangzhou Apichem | Building Blocks in stock | 95 | As an isomer | in stock |
P-888635980 | TargetMol | Screening Compounds | 95 | As an isomer | by synthesis |
P-869121314 | TargetMol | Screening Compounds - stock amount | 95 | As an isomer | in stock |
P-855067108 | Toronto Research | In stock | 90 | As an isomer | in stock |
P-575296922 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As an isomer | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 501.539 |
logP | 4.8743 |
H-bond acceptors | 6 |
H-bond donors | 3 |
Rotatable bonds | 8 |
PSA | 81.67 |
RO5 violations | 1 |
RO3 violations | 5 |
Refractivity | 141.4232 |
Atoms | 66 |
Rings | 3 |
Heavy atoms | 36 |
Hydrogen atoms | 30 |
Heteroatoms | 9 |
N/O atoms | 6 |
Inorganic atoms | 0 |
Halogen atoms | 3 |
Chiral centers | 2 |
R/S chiral centers | 2 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 2 |
Cis/trans stereo double bonds | 2 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |