MCULE-3503168841
- 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 | 7 USD | N/A | 14 working days | Get Quote |
5 mg | 10 USD | N/A | 14 working days | Get Quote |
10 mg | 15 USD | N/A | 14 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-3503168841.sdf |
SMILES | MCULE-3503168841.smiles |
Standard InChI | MCULE-3503168841.inchi |
InChIKey | MCULE-3503168841.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867604784 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-590397796 | AK Scientific | Building Blocks | 98 | As is | in stock |
P-606927655 | AmBeed | In stock | N/A | As is | in stock |
P-596960268 | Angene | Building Blocks in stock | 98 | As is | 19.7 g |
P-580194700 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
P-480967655 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
Property | Value |
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Components | 1 |
Mass | 810.450 |
logP | 5.6573 |
H-bond acceptors | 12 |
H-bond donors | 2 |
Rotatable bonds | 6 |
PSA | 158.13 |
RO5 violations | 3 |
RO3 violations | 5 |
Refractivity | 219.6046 |
Atoms | 124 |
Rings | 4 |
Heavy atoms | 56 |
Hydrogen atoms | 68 |
Heteroatoms | 13 |
N/O atoms | 12 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
Chiral centers | 14 |
R/S chiral centers | 14 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 2 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 2 |
Undefined stereo double bonds | 0 |