MCULE-4745245024
- 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 | 44 USD | 90 | 21 working days | Get Quote |
5 mg | 71 USD | 90 | 21 working days | Get Quote |
10 mg | 85 USD | 90 | 21 working days | Get Quote |
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MCULE-3881117868
- Component type: Main
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MCULE-1804285446
- Component type: Main
Name | File |
---|---|
SDF | MCULE-4745245024.sdf |
SMILES | MCULE-4745245024.smiles |
Standard InChI | MCULE-4745245024.inchi |
InChIKey | MCULE-4745245024.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-594279995 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 1 mg |
P-448705883 | ChemDiv | Discovery Chemistry Library | 90 | As is | unavailable |
P-12376998 | Otava | In-House Stock Library | 90 | As is | 299 mg |
P-617684373 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As is | 299 mg |
P-674953672 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As a main component | 318 mg |
P-26361396 | Otava | In-House Stock Library | 90 | As a main component | 535 mg |
P-617684381 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As a main component | 535 mg |
P-674790463 | Otava | In-House Stock Library | 90 | As a main component | 318 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 391.382 |
logP | 5.0262 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 6 |
PSA | 53.68 |
RO5 violations | 1 |
RO3 violations | 4 |
Refractivity | 102.035 |
Atoms | 48 |
Rings | 3 |
Heavy atoms | 28 |
Hydrogen atoms | 20 |
Heteroatoms | 7 |
N/O atoms | 4 |
Inorganic atoms | 0 |
Halogen atoms | 3 |
Chiral centers | 0 |
R/S chiral centers | 0 |
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 |