MCULE-3486870731
- 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 | 14 USD | 95 | 20 working days | Get Quote |
5 mg | 14 USD | 95 | 20 working days | Get Quote |
10 mg | 14 USD | 95 | 20 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-6797973703
- Component type: Main
Name | File |
---|---|
SDF | MCULE-3486870731.sdf |
SMILES | MCULE-3486870731.smiles |
Standard InChI | MCULE-3486870731.inchi |
InChIKey | MCULE-3486870731.txt |
mcule product ID | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|
P-867605773 | 95 | As is | in stock |
P-875764137 | N/A | As is | in stock |
P-869189012 | 95 | As is | in stock |
P-590359998 | 98 | As is | in stock |
P-903101888 | 95 | As is | 175 g |
P-893512655 | 90 | As is | 353.199 g |
P-851932009 | N/A | As is | in stock |
P-865913318 | 95 | As is | 125 g |
P-864192471 | 95 | As is | in stock |
P-492258084 | 95 | As is | in stock |
P-492248141 | 95 | As is | in stock |
P-619926620 | 90 | As is | by synthesis |
P-619844435 | 90 | As is | 47 mg |
P-436446900 | 95 | As is | 24 g |
P-19940302 | 90 | As is | in stock |
P-868584966 | 95 | As is | in stock |
P-34771463 | 90 | As is | in stock |
P-580777858 | 90 | As is | by resynthesis (? - ? days) |
P-580767141 | 90 | As is | in stock |
P-580393628 | N/A | As is | by resynthesis (? - ? days) |
P-905330522 | 95 | As is | 1000 mg |
P-861936026 | 95 | As is | 182.559 g |
P-590341949 | 90 | As is | 6.9 g |
P-502447756 | 95 | As is | by synthesis |
P-502939145 | 90 | As is | in stock |
P-492236432 | 95 | As is | in stock |
P-870638709 | 90 | As is | 8.545 g |
P-856040359 | 90 | As is | unavailable |
P-31210061 | 90 | As is | 1000 mg |
P-580502859 | N/A | As is | by synthesis |
P-852397264 | N/A | As is | in stock |
P-895896306 | 95 | As is | in stock |
P-26425906 | 90 | As is | 310 mg |
P-492278398 | 95 | As is | 310 mg |
P-491130036 | 95 | As is | by synthesis |
P-424802919 | 90 | As is | in stock |
P-502326383 | 90 | As is | in stock |
P-22453326 | 90 | As is | 213 mg |
P-906864504 | 95 | As is | by synthesis |
P-611498886 | 90 | As is | in stock |
P-3231662 | 90 | As is | 2.499 g |
P-3241453 | 90 | As is | 2.499 g |
P-408059 | 90 | As is | 2.499 g |
P-667024481 | 95 | As is | in stock |
P-896012254 | 95 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 142.199 |
logP | 1.6478 |
H-bond acceptors | 3 |
H-bond donors | 2 |
Rotatable bonds | 2 |
PSA | 55.12 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 39.3581 |
Atoms | 24 |
Rings | 1 |
Heavy atoms | 10 |
Hydrogen atoms | 14 |
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 |