MCULE-1154941681
- 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 | 186 USD | N/A | 35 working days | Get Quote |
5 mg | 369 USD | 98 | 11 working days | Get Quote |
10 mg | 739 USD | 98 | 11 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-1154941681.sdf |
SMILES | MCULE-1154941681.smiles |
Standard InChI | MCULE-1154941681.inchi |
InChIKey | MCULE-1154941681.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867727780 | AmBeed | On request | N/A | As is | by synthesis |
P-25957170 | AnalytiCon Discovery | Natural screening compounds (85%+) | 85 | As is | 36 mg |
P-619593667 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-452650517 | Chemfaces | Natural Compounds | 98 | As is | in stock |
P-878204260 | Key Organics | Building Blocks | 95 | As is | 5 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 272.252 |
logP | 2.2576 |
H-bond acceptors | 5 |
H-bond donors | 3 |
Rotatable bonds | 1 |
PSA | 86.99 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 71.1295 |
Atoms | 32 |
Rings | 3 |
Heavy atoms | 20 |
Hydrogen atoms | 12 |
Heteroatoms | 5 |
N/O atoms | 5 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 1 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 1 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |