MCULE-3447039960-0
- 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 | 6 USD | 97 | 14 working days | Get Quote |
5 mg | 6 USD | 97 | 14 working days | Get Quote |
10 mg | 6 USD | 97 | 14 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-7057389039-0
- Component type: Main
Name | File |
---|---|
SDF | MCULE-3447039960-0.sdf |
SMILES | MCULE-3447039960-0.smiles |
Standard InChI | MCULE-3447039960-0.inchi |
InChIKey | MCULE-3447039960-0.txt |
mcule product ID | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|
P-867607550 | 97 | As is | in stock |
P-875766319 | N/A | As is | in stock |
P-590389871 | 95 | As is | in stock |
P-903104135 | 98 | As is | 100 g |
P-905489798 | 97 | As is | 1000 g |
P-610975398 | 90 | As is | 3.35332 kg |
P-893338845 | 95 | As is | by synthesis |
P-865624157 | 95 | As is | by synthesis |
P-606880212 | N/A | As is | in stock |
P-489232797 | 97 | As is | in stock |
P-596961403 | 96 | As is | 42.93 g |
P-494353335 | 95 | As is | 10.2 g |
P-864136310 | 95 | As is | in stock |
P-580709702 | 97 | As is | 3.6 g |
P-505610748 | 95 | As is | by synthesis |
P-851247679 | 95 | As is | by synthesis |
P-861277872 | 95 | As is | in stock |
P-868617475 | 97 | As is | in stock |
P-489246941 | 95 | As is | in stock |
P-862010580 | 95 | As is | 313.422 g |
P-905340641 | 95 | As is | 500 mg |
P-890211332 | 90 | As is | in stock |
P-579522502 | 90 | As is | 1 mg |
P-500152368 | 96 | As is | in stock |
P-524189443 | 97 | As is | 5 g |
P-579624590 | 95 | As is | 25 g |
P-580481104 | N/A | As is | by synthesis |
P-852503338 | N/A | As is | in stock |
P-854720693 | 95 | As is | in stock |
P-875882198 | 95 | As is | in stock |
P-888883253 | N/A | As is | in stock |
P-859988786 | 95 | As is | by synthesis |
P-873281179 | N/A | As is | in stock |
P-596745013 | 97 | As is | 142 g |
P-873219663 | 90 | As is | in stock |
P-855061632 | 90 | As is | in stock |
P-893946574 | 95 | As is | in stock |
P-867569454 | 97 | As a main component | in stock |
P-875729990 | N/A | As a main component | in stock |
P-535627007 | 95 | As a main component | in stock |
P-505397541 | 98 | As a main component | in stock |
P-903059210 | 97 | As a main component | 25 g |
P-905482908 | 98 | As a main component | 100 g |
P-580241086 | 95 | As a main component | by synthesis |
P-606943865 | N/A | As a main component | in stock |
P-489169033 | 97 | As a main component | in stock |
P-596949034 | 98 | As a main component | 3.5 kg |
P-494342724 | 95 | As a main component | by resynthesis (? - ? days) |
P-864106860 | 95 | As a main component | in stock |
P-580721188 | 97 | As a main component | 115 g |
P-905499597 | N/A | As a main component | in stock |
P-901450871 | 95 | As a main component | by synthesis |
P-505605138 | 95 | As a main component | by synthesis |
P-851312040 | 95 | As a main component | by synthesis |
P-868639891 | 98 | As a main component | in stock |
P-862045597 | 97 | As a main component | 6.08356 kg |
P-905348095 | 97 | As a main component | 305 g |
P-454403990 | 95 | As a main component | 100 g |
P-611662872 | N/A | As a main component | 740 g |
P-852406499 | N/A | As a main component | in stock |
P-428002724 | 90 | As a main component | 22.2 kg |
P-620223213 | 95 | As a main component | 1000 mg |
P-620068089 | 90 | As a main component | 170 mg |
P-888883254 | N/A | As a main component | in stock |
P-500410376 | 98 | As a main component | by synthesis |
P-596754280 | 95 | As a main component | 2.272 kg |
P-873224971 | 90 | As a main component | in stock |
P-611409960 | 90 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 145.199 |
logP | 1.3772 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 4 |
PSA | 52.32 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 39.7934 |
Atoms | 25 |
Rings | 0 |
Heavy atoms | 10 |
Hydrogen atoms | 15 |
Heteroatoms | 3 |
N/O atoms | 3 |
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 |