MCULE-1054926598
- 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 | 18 USD | 98 | 16 working days | Get Quote |
5 mg | 44 USD | 98 | 16 working days | Get Quote |
10 mg | 59 USD | 98 | 16 working days | Get Quote |
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Name | File |
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SDF | MCULE-1054926598.sdf |
SMILES | MCULE-1054926598.smiles |
Standard InChI | MCULE-1054926598.inchi |
InChIKey | MCULE-1054926598.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867616407 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875777702 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-590360228 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-505401957 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-606904788 | AmBeed | In stock | N/A | As is | in stock |
P-596963780 | Angene | Building Blocks in stock | 98 | As is | 400 mg |
P-864173641 | AstaTech | In Stock BBs | 98 | As is | in stock |
P-868544413 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
P-860799477 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
P-675216026 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-888641507 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
P-869129035 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
P-480967670 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
Property | Value |
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Components | 1 |
Mass | 462.590 |
logP | 4.8077 |
H-bond acceptors | 9 |
H-bond donors | 4 |
Rotatable bonds | 6 |
PSA | 124.85 |
RO5 violations | 0 |
RO3 violations | 6 |
Refractivity | 139.6225 |
Atoms | 68 |
Rings | 5 |
Heavy atoms | 34 |
Hydrogen atoms | 34 |
Heteroatoms | 9 |
N/O atoms | 9 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
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 |