MCULE-4955083768
- 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 | 45 USD | 90 | 23 working days | Get Quote |
5 mg | 99 USD | 98 | 20 working days | Get Quote |
10 mg | 176 USD | 98 | 20 working days | Get Quote |
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Name | File |
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SDF | MCULE-4955083768.sdf |
SMILES | MCULE-4955083768.smiles |
Standard InChI | MCULE-4955083768.inchi |
InChIKey | MCULE-4955083768.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867626430 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-874643135 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-851948717 | AmBeed | In stock | N/A | As is | in stock |
P-865918880 | Angene | Building Blocks in stock | 98 | As is | 808 mg |
P-864205743 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-855959862 | Key Organics | Building Blocks | 97 | As is | 1 mg |
P-424436838 | Otava | In-House Stock Library | 90 | As is | 2 mg |
P-888658916 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
P-869163572 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
P-868508282 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 254.236 |
logP | 2.714 |
H-bond acceptors | 4 |
H-bond donors | 2 |
Rotatable bonds | 1 |
PSA | 66.76 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 69.8655 |
Atoms | 29 |
Rings | 3 |
Heavy atoms | 19 |
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 | 1 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 1 |
Undefined stereo double bonds | 0 |