MCULE-5305811185-0
- 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.
|
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 | 49 USD | 97 | 15 working days | Get Quote |
5 mg | 49 USD | 97 | 15 working days | Get Quote |
10 mg | 49 USD | 97 | 15 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.
-
MCULE-5428190802-0
- Component type: Main
Name | File |
---|---|
SDF | MCULE-5305811185-0.sdf |
SMILES | MCULE-5305811185-0.smiles |
Standard InChI | MCULE-5305811185-0.inchi |
InChIKey | MCULE-5305811185-0.txt |
mcule product ID | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|
P-867576834 | 95 | As is | in stock |
P-875736770 | N/A | As is | in stock |
P-590402298 | 95 | As is | in stock |
P-903067149 | 97 | As is | 5 g |
P-610978410 | 90 | As is | 1.031 kg |
P-851934365 | N/A | As is | in stock |
P-865909102 | 97 | As is | 3 g |
P-864189884 | 95 | As is | in stock |
P-674400811 | 97 | As is | 1.014 g |
P-893252608 | 95 | As is | by synthesis |
P-492257564 | 95 | As is | in stock |
P-872448371 | 90 | As is | 50 mg |
P-454721184 | 90 | As is | in stock |
P-436464619 | 95 | As is | 24 g |
P-861412188 | 95 | As is | by synthesis |
P-890209826 | 90 | As is | in stock |
P-579516010 | 90 | As is | 23 g |
P-502568668 | 95 | As is | by synthesis |
P-18817345 | 90 | As is | 898 mg |
P-870137617 | 95 | As is | unavailable |
P-852446137 | N/A | As is | in stock |
P-854890243 | 95 | As is | by synthesis |
P-859985167 | 95 | As is | by synthesis |
P-906867137 | 97 | As is | by synthesis |
P-611560472 | 90 | As is | in stock |
P-893994492 | 95 | As is | in stock |
P-886648778 | 96 | As a main component | in stock |
P-901284769 | N/A | As a main component | in stock |
P-590388152 | 95 | As a main component | in stock |
P-903209119 | 95 | As a main component | 2.5 g |
P-851461262 | N/A | As a main component | by synthesis |
P-889809158 | 95 | As a main component | by synthesis |
P-590769992 | 95 | As a main component | by synthesis |
P-905501831 | N/A | As a main component | in stock |
P-905501832 | N/A | As a main component | in stock |
P-901509929 | 95 | As a main component | by synthesis |
P-868584921 | 96 | As a main component | in stock |
P-855943609 | 95 | As a main component | 5 g |
P-854834868 | 95 | As a main component | by synthesis |
P-611419680 | 90 | As a main component | in stock |
P-893834458 | 95 | As a main component | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 129.157 |
logP | 0.8987 |
H-bond acceptors | 3 |
H-bond donors | 2 |
Rotatable bonds | 2 |
PSA | 63.32 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 33.3592 |
Atoms | 20 |
Rings | 1 |
Heavy atoms | 9 |
Hydrogen atoms | 11 |
Heteroatoms | 3 |
N/O atoms | 3 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 1 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 1 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |