MCULE-5512333475
- 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 | 39 USD | 95 | 11 working days | Get Quote |
5 mg | 95 USD | 95 | 11 working days | Get Quote |
10 mg | 189 USD | 95 | 11 working days | Get Quote |
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MCULE-1492922873
- Component type: Main
Name | File |
---|---|
SDF | MCULE-5512333475.sdf |
SMILES | MCULE-5512333475.smiles |
Standard InChI | MCULE-5512333475.inchi |
InChIKey | MCULE-5512333475.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867624414 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
P-875787653 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-888629604 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
P-869111769 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
P-611498503 | Toronto Research | In stock | 90 | As is | in stock |
P-611347412 | Toronto Research | In stock | 90 | As is | in stock |
P-868540676 | eNovation Chemicals LLC | Building Blocks in stock | 99 | As is | in stock |
P-886736660 | A2B Chem | Predominantly Building Block in stock | 99 | As a main component | in stock |
P-890182495 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
P-889795101 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
P-888629603 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
P-869111768 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 869.644 |
logP | 5.9064 |
H-bond acceptors | 14 |
H-bond donors | 5 |
Rotatable bonds | 16 |
PSA | 176.47 |
RO5 violations | 3 |
RO3 violations | 6 |
Refractivity | 230.5225 |
Atoms | 101 |
Rings | 6 |
Heavy atoms | 54 |
Hydrogen atoms | 47 |
Heteroatoms | 16 |
N/O atoms | 14 |
Inorganic atoms | 0 |
Halogen atoms | 2 |
Chiral centers | 2 |
R/S chiral centers | 2 |
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 |