MCULE-1968967516-0
- 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 | 34 USD | 90 | 19 working days | Get Quote |
5 mg | 51 USD | 90 | 19 working days | Get Quote |
10 mg | 65 USD | 90 | 19 working days | Get Quote |
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Name | File |
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SDF | MCULE-1968967516-0.sdf |
SMILES | MCULE-1968967516-0.smiles |
Standard InChI | MCULE-1968967516-0.inchi |
InChIKey | MCULE-1968967516-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-892980754 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-454689778 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
P-15158270 | ChemDiv | Discovery Chemistry Library | 90 | As is | 2 mg |
P-436445053 | Chemical Block | Building Blocks | 90 | As is | 29.69 g |
P-357427 | Chemical Block | Screening Library | 90 | As is | 242 mg |
P-34734131 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
P-13916490 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
P-502359604 | TimTec | Building Block Collection | 90 | As is | in stock |
P-2799825 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 61 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 253.259 |
logP | 1.9373 |
H-bond acceptors | 6 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 76.58 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 69.3367 |
Atoms | 30 |
Rings | 3 |
Heavy atoms | 19 |
Hydrogen atoms | 11 |
Heteroatoms | 6 |
N/O atoms | 6 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
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 |