MCULE-6290521968-0
- 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 | 260 USD | 90 | 9 working days | Get Quote |
5 mg | 260 USD | 90 | 9 working days | Get Quote |
10 mg | 260 USD | 90 | 9 working days | Get Quote |
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Name | File |
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SDF | MCULE-6290521968-0.sdf |
SMILES | MCULE-6290521968-0.smiles |
Standard InChI | MCULE-6290521968-0.inchi |
InChIKey | MCULE-6290521968-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-596351551 | Asinex | General screening catalog | 90 | As is | 606 mg |
P-12528236 | Specs | Screening Compounds | 90 | As is | 13 mg |
P-33554404 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
Property | Value |
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Components | 1 |
Mass | 393.385 |
logP | 4.8676 |
H-bond acceptors | 5 |
H-bond donors | 1 |
Rotatable bonds | 7 |
PSA | 93.32 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 95.2567 |
Atoms | 41 |
Rings | 3 |
Heavy atoms | 27 |
Hydrogen atoms | 14 |
Heteroatoms | 9 |
N/O atoms | 5 |
Inorganic atoms | 0 |
Halogen atoms | 3 |
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 |