MCULE-3370370971
- 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 | 143 USD | 95 | 11 working days | Get Quote |
5 mg | 324 USD | 95 | 11 working days | Get Quote |
10 mg | 486 USD | 95 | 11 working days | Get Quote |
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MCULE-1154311751
- Component type: Main
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MCULE-1049511688
- Component type: Main
Name | File |
---|---|
SDF | MCULE-3370370971.sdf |
SMILES | MCULE-3370370971.smiles |
Standard InChI | MCULE-3370370971.inchi |
InChIKey | MCULE-3370370971.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
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P-867678713 | A2B Chem | Predominantly Building Block in stock | 95 | As a main component | in stock |
P-875856299 | AA Blocks | AA Blocks - in stock | N/A | As a main component | in stock |
P-888664135 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
P-869172961 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 1081.268 |
logP | 4.5427 |
H-bond acceptors | 24 |
H-bond donors | 13 |
Rotatable bonds | 40 |
PSA | 412.1 |
RO5 violations | 3 |
RO3 violations | 6 |
Refractivity | 292.0636 |
Atoms | 154 |
Rings | 4 |
Heavy atoms | 78 |
Hydrogen atoms | 76 |
Heteroatoms | 24 |
N/O atoms | 24 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 8 |
R/S chiral centers | 8 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 1 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 1 |