MCULE-6589454206
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
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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 | 106 USD | 90 | 8 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 |
---|---|
SDF | MCULE-6589454206.sdf |
SMILES | MCULE-6589454206.smiles |
Standard InChI | MCULE-6589454206.inchi |
InChIKey | MCULE-6589454206.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-596491362 | Asinex | General bb catalog | 90 | As is | 27 mg |
P-596395821 | Asinex | General screening catalog | 90 | As is | 27 mg |
P-18865619 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-22479750 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 78 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 256.298 |
logP | -1.1712 |
H-bond acceptors | 6 |
H-bond donors | 2 |
Rotatable bonds | 5 |
PSA | 81.08 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 71.9156 |
Atoms | 38 |
Rings | 2 |
Heavy atoms | 18 |
Hydrogen atoms | 20 |
Heteroatoms | 6 |
N/O atoms | 6 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 2 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 2 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |