MCULE-1481999952
- 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 | 19 working days | Get Quote |
5 mg | 49 USD | 90 | 19 working days | Get Quote |
10 mg | 63 USD | 90 | 19 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-1481999952.sdf |
SMILES | MCULE-1481999952.smiles |
Standard InChI | MCULE-1481999952.inchi |
InChIKey | MCULE-1481999952.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-427964494 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 5 mg |
P-19423916 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-25168952 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 389 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 313.143 |
logP | 2.8459 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 7 |
PSA | 71.44 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 70.3433 |
Atoms | 31 |
Rings | 1 |
Heavy atoms | 18 |
Hydrogen atoms | 13 |
Heteroatoms | 5 |
N/O atoms | 4 |
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 | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |