MCULE-7129013442
- 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 | 90 | 14 working days | Get Quote |
5 mg | 27 USD | 90 | 14 working days | Get Quote |
10 mg | 37 USD | 90 | 14 working days | Get Quote |
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Name | File |
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SDF | MCULE-7129013442.sdf |
SMILES | MCULE-7129013442.smiles |
Standard InChI | MCULE-7129013442.inchi |
InChIKey | MCULE-7129013442.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886667254 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-889970216 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-869257234 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-851751127 | AmBeed | On request | N/A | As is | by synthesis |
P-611128776 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-893258539 | Biosynth | Synthesis | 95 | As is | by synthesis |
P-861399170 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-862053814 | FluoroChem | General BB | N/A | As is | in stock |
P-854861111 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-579724464 | Menai Organics | Building blocks | 90 | As is | in stock |
P-888164614 | Menai Organics | Screening compounds | 90 | As is | in stock |
P-611610047 | Toronto Research | In stock | 90 | As is | in stock |
P-893829609 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
Property | Value |
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Components | 1 |
Mass | 227.685 |
logP | 2.6424 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 4 |
PSA | 38.33 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 61.8157 |
Atoms | 29 |
Rings | 1 |
Heavy atoms | 15 |
Hydrogen atoms | 14 |
Heteroatoms | 4 |
N/O atoms | 3 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
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 |