MCULE-4735381890
- 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 | 156 USD | N/A | 35 working days | Get Quote |
5 mg | 468 USD | N/A | 35 working days | Get Quote |
10 mg | 754 USD | N/A | 35 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-4735381890.sdf |
SMILES | MCULE-4735381890.smiles |
Standard InChI | MCULE-4735381890.inchi |
InChIKey | MCULE-4735381890.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867624443 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875786722 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869274125 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-891659577 | AmBeed | On request | N/A | As is | by synthesis |
P-888654395 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
P-869158634 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 495.549 |
logP | 3.7304 |
H-bond acceptors | 9 |
H-bond donors | 2 |
Rotatable bonds | 8 |
PSA | 124.63 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 135.6467 |
Atoms | 60 |
Rings | 4 |
Heavy atoms | 35 |
Hydrogen atoms | 25 |
Heteroatoms | 10 |
N/O atoms | 9 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 1 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 1 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |