MCULE-3914211997
- 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 | 33 USD | 90 | 23 working days | Get Quote |
5 mg | 51 USD | 90 | 19 working days | Get Quote |
10 mg | 65 USD | 90 | 19 working days | Get Quote |
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Name | File |
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SDF | MCULE-3914211997.sdf |
SMILES | MCULE-3914211997.smiles |
Standard InChI | MCULE-3914211997.inchi |
InChIKey | MCULE-3914211997.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-22379431 | ChemDiv | New Chemistry Library | 90 | As is | 23 mg |
P-516884411 | Eximed | In-stock screening compounds | 90 | As is | 5 mg |
P-13730760 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
P-26475633 | Otava | In-House Stock Library | 90 | As is | 5 mg |
P-13853063 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
P-520018608 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-2099492 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 69 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 231.297 |
logP | 1.9129 |
H-bond acceptors | 5 |
H-bond donors | 0 |
Rotatable bonds | 2 |
PSA | 46.32 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 70.004 |
Atoms | 34 |
Rings | 3 |
Heavy atoms | 17 |
Hydrogen atoms | 17 |
Heteroatoms | 5 |
N/O atoms | 5 |
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 | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |