MCULE-3853998291
- 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 | 384 USD | 95 | 63 working days | Get Quote |
5 mg | 468 USD | 95 | 10 working days | Get Quote |
10 mg | 468 USD | 95 | 10 working days | Get Quote |
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MCULE-8162025772
- Component type: Main
Name | File |
---|---|
SDF | MCULE-3853998291.sdf |
SMILES | MCULE-3853998291.smiles |
Standard InChI | MCULE-3853998291.inchi |
InChIKey | MCULE-3853998291.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-584622599 | MedKoo | In stock compounds | 95 | As is | in stock |
P-889521673 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 1305.220 |
logP | 13.3274 |
H-bond acceptors | 29 |
H-bond donors | 12 |
Rotatable bonds | 22 |
PSA | 534.03 |
RO5 violations | 4 |
RO3 violations | 6 |
Refractivity | 296.101 |
Atoms | 120 |
Rings | 8 |
Heavy atoms | 86 |
Hydrogen atoms | 34 |
Heteroatoms | 37 |
N/O atoms | 29 |
Inorganic atoms | 0 |
Halogen atoms | 2 |
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 |