MCULE-9515143145
- 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.
|
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.
|
|
---|---|---|---|---|
1 mg | 6 USD | 98 | 22 working days | Get Quote |
5 mg | 6 USD | 98 | 22 working days | Get Quote |
10 mg | 6 USD | 98 | 22 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
Name | File |
---|---|
SDF | MCULE-9515143145.sdf |
SMILES | MCULE-9515143145.smiles |
Standard InChI | MCULE-9515143145.inchi |
InChIKey | MCULE-9515143145.txt |
mcule product ID | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|
P-867568199 | 98 | As is | in stock |
P-875728208 | N/A | As is | in stock |
P-535626253 | 95 | As is | in stock |
P-505399844 | 98 | As is | in stock |
P-903057547 | 98 | As is | 190 g |
P-893569916 | 90 | As is | 451.196 g |
P-606892100 | N/A | As is | in stock |
P-489139480 | 97 | As is | in stock |
P-596992326 | 98 | As is | 185 g |
P-494348709 | 95 | As is | 1.9 g |
P-595589231 | 90 | As is | 63 mg |
P-864144848 | 95 | As is | in stock |
P-615697509 | 98 | As is | 43 g |
P-901488874 | 95 | As is | by synthesis |
P-619930195 | 90 | As is | by synthesis |
P-851241584 | 95 | As is | by synthesis |
P-868641452 | 98 | As is | in stock |
P-580442131 | 95 | As is | by resynthesis (? - ? days) |
P-905331378 | 95 | As is | 11 g |
P-861950687 | 95 | As is | 227.818 g |
P-502451697 | 95 | As is | by synthesis |
P-503137556 | 90 | As is | by synthesis |
P-502670940 | 90 | As is | in stock |
P-492221784 | 95 | As is | in stock |
P-488553476 | 90 | As is | in stock |
P-18793076 | 95 | As is | 17.779 g |
P-454405604 | 95 | As is | 25 g |
P-579687489 | 97 | As is | by resynthesis (? - ? days) |
P-14199816 | 90 | As is | 86 mg |
P-580500535 | N/A | As is | by synthesis |
P-852380733 | N/A | As is | in stock |
P-854739875 | 95 | As is | in stock |
P-454370471 | 92 | As is | in stock |
P-13319139 | 92 | As is | 300 mg |
P-500399210 | 95 | As is | by synthesis |
P-885543633 | 95 | As is | by synthesis |
P-18892870 | 90 | As is | in stock |
P-873278939 | N/A | As is | in stock |
P-502334416 | 90 | As is | in stock |
P-22525986 | 90 | As is | 600 mg |
P-906753506 | 98 | As is | by synthesis |
P-611397218 | 90 | As is | in stock |
P-615451084 | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 189.253 |
logP | 2.5544 |
H-bond acceptors | 2 |
H-bond donors | 0 |
Rotatable bonds | 2 |
PSA | 20.31 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 61.2785 |
Atoms | 29 |
Rings | 2 |
Heavy atoms | 14 |
Hydrogen atoms | 15 |
Heteroatoms | 2 |
N/O atoms | 2 |
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 |