MCULE-6846516221
- 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 | 50 USD | 90 | 19 working days | Get Quote |
10 mg | 64 USD | 90 | 19 working days | Get Quote |
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Name | File |
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SDF | MCULE-6846516221.sdf |
SMILES | MCULE-6846516221.smiles |
Standard InChI | MCULE-6846516221.inchi |
InChIKey | MCULE-6846516221.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-870130158 | ChemDiv | Discovery Chemistry Library | 90 | As is | unavailable |
P-579805285 | Eximed | In-stock screening compounds | 90 | As is | 455 mg |
P-580090030 | Eximed | Building Block Catalog | 95 | As is | 455 mg |
P-870580569 | Innovapharm | Building Blocks | 95 | As is | in stock |
P-870569299 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-13984948 | InterBioScreen | Natural Compounds | 92 | As is | 300 mg |
P-620217508 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As is | 455 mg |
P-674810970 | Otava | In-House Stock Library | 90 | As is | 455 mg |
P-13863845 | Pharmeks LLC | Semi-natural compounds | 92 | As is | 300 mg |
P-578101282 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 110 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 242.315 |
logP | 2.5093 |
H-bond acceptors | 5 |
H-bond donors | 3 |
Rotatable bonds | 7 |
PSA | 78.43 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 65.6482 |
Atoms | 39 |
Rings | 1 |
Heavy atoms | 17 |
Hydrogen atoms | 22 |
Heteroatoms | 5 |
N/O atoms | 5 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 1 |
R/S chiral centers | 1 |
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 |