MCULE-1987346990
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
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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 | 35 USD | 90 | 17 working days | Get Quote |
5 mg | 52 USD | 90 | 17 working days | Get Quote |
10 mg | 67 USD | 90 | 17 working days | Get Quote |
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1
MCULE-3066030206
- Component type: Main
-
1
MCULE-6647815245
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-1987346990.sdf |
SMILES | MCULE-1987346990.smiles |
Standard InChI | MCULE-1987346990.inchi |
InChIKey | MCULE-1987346990.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-4522454 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 20 mg |
P-674267760 | ChemDiv | Discovery Chemistry Library | 90 | As is | 20 mg |
P-34559468 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
P-675075542 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-617744807 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 145 mg |
P-596357180 | Asinex | General screening catalog | 90 | Main component | unavailable |
P-654955830 | Otava | Tangible screening compounds | 90 | Main component | by synthesis |
P-454132480 | Specs | Screening Compounds | 90 | Main component | 56 mg |
P-22518974 | TimTec | ActiMol 1 Week - Stock | 90 | Main component | 10 mg |
P-677777145 | Ultimate 3P | Express 1 | 90 | Main component | by synthesis |
Property | Value |
---|---|
Components | 2 |
Mass | 448.440 |
logP | 1.8323 |
H-bond acceptors | 9 |
H-bond donors | 2 |
Rotatable bonds | 7 |
PSA | 116.61 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 120.0731 |
Atoms | 57 |
Rings | 3 |
Heavy atoms | 32 |
Hydrogen atoms | 25 |
Heteroatoms | 10 |
N/O atoms | 9 |
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 |