MCULE-4273697701
- 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 | 17 working days | Get Quote |
5 mg | 50 USD | 90 | 17 working days | Get Quote |
10 mg | 64 USD | 90 | 17 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-4273697701.sdf |
SMILES | MCULE-4273697701.smiles |
Standard InChI | MCULE-4273697701.inchi |
InChIKey | MCULE-4273697701.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-885852683 | Alinda | Building Blocks | 95 | As is | in stock |
P-19529530 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-502338012 | TimTec | Building Block Collection | 90 | As is | in stock |
P-22513588 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
P-995153 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 192 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 469.962 |
logP | 5.68 |
H-bond acceptors | 5 |
H-bond donors | 1 |
Rotatable bonds | 6 |
PSA | 128.14 |
RO5 violations | 1 |
RO3 violations | 5 |
Refractivity | 130.1983 |
Atoms | 47 |
Rings | 4 |
Heavy atoms | 31 |
Hydrogen atoms | 16 |
Heteroatoms | 8 |
N/O atoms | 5 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
Chiral centers | 0 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 1 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 1 |
Undefined stereo double bonds | 0 |