MCULE-3593851047-1
- 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 | 130 USD | 90 | 27 working days | Get Quote |
5 mg | 130 USD | 90 | 27 working days | Get Quote |
10 mg | 130 USD | 90 | 27 working days | Get Quote |
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1
MCULE-5735787652-0
- Component type: Main
-
1
MCULE-1858636187-1
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-3593851047-1.sdf |
SMILES | MCULE-3593851047-1.smiles |
Standard InChI | MCULE-3593851047-1.inchi |
InChIKey | MCULE-3593851047-1.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-854585692 | InterBioScreen | Natural Compounds | 92 | As is | 300 mg |
P-867532426 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
P-855928686 | Key Organics | Building Blocks | 95 | Main component | 1 mg |
P-18914569 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
P-892217661 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
P-892313232 | TargetMol | Screening Compounds - stock amount | 95 | Main component | unavailable |
Property | Value |
---|---|
Components | 2 |
Mass | 348.821 |
logP | 1.9038 |
H-bond acceptors | 7 |
H-bond donors | 1 |
Rotatable bonds | 0 |
PSA | 94.99 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 89.4333 |
Atoms | 48 |
Rings | 4 |
Heavy atoms | 23 |
Hydrogen atoms | 25 |
Heteroatoms | 8 |
N/O atoms | 7 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
Chiral centers | 4 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 4 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |