MCULE-5773017891-0
- InChIKey:
- SMILES:
- InChI:
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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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Name | File |
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SDF | MCULE-5773017891-0.sdf |
SMILES | MCULE-5773017891-0.smiles |
Standard InChI | MCULE-5773017891-0.inchi |
InChIKey | MCULE-5773017891-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-519901029 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-491122486 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 237.284 |
logP | 0.0358 |
H-bond acceptors | 6 |
H-bond donors | 1 |
Rotatable bonds | 1 |
PSA | 91.59 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 65.8407 |
Atoms | 27 |
Rings | 3 |
Heavy atoms | 16 |
Hydrogen atoms | 11 |
Heteroatoms | 7 |
N/O atoms | 6 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
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 |