MCULE-9387026766
- 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 | 89 USD | 90 | 17 working days | Get Quote |
5 mg | 97 USD | 90 | 17 working days | Get Quote |
10 mg | 109 USD | 90 | 20 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-9387026766.sdf |
SMILES | MCULE-9387026766.smiles |
Standard InChI | MCULE-9387026766.inchi |
InChIKey | MCULE-9387026766.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-893083869 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-893071295 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-449225308 | ChemDiv | Discovery Chemistry Library | 90 | As is | 8 mg |
P-502674159 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-502444655 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-856015304 | LaboTest | Screening Collection | 90 | As is | 500 mg |
P-18935717 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-3243359 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 77 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 219.262 |
logP | 2.6477 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 1 |
PSA | 71.47 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 64.0957 |
Atoms | 24 |
Rings | 2 |
Heavy atoms | 15 |
Hydrogen atoms | 9 |
Heteroatoms | 4 |
N/O atoms | 3 |
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 | 1 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 1 |
Undefined stereo double bonds | 0 |