MCULE-1125503092
- 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 | 89 USD | 96 | 20 working days | Get Quote |
5 mg | 288 USD | 96 | 20 working days | Get Quote |
10 mg | 438 USD | 96 | 20 working days | Get Quote |
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Name | File |
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SDF | MCULE-1125503092.sdf |
SMILES | MCULE-1125503092.smiles |
Standard InChI | MCULE-1125503092.inchi |
InChIKey | MCULE-1125503092.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867678613 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
P-875856203 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-888826864 | Angene | Building Blocks in stock | 96 | As is | 10 mg |
P-870660003 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 3563.163 |
logP | 9.5891 |
H-bond acceptors | 91 |
H-bond donors | 51 |
Rotatable bonds | 145 |
PSA | 1489.66 |
RO5 violations | 4 |
RO3 violations | 6 |
Refractivity | 931.1374 |
Atoms | 521 |
Rings | 4 |
Heavy atoms | 252 |
Hydrogen atoms | 269 |
Heteroatoms | 91 |
N/O atoms | 91 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 32 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 32 |
Stereo double bonds | 3 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 3 |