MCULE-5346185215
- 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.
| Name | File |
|---|---|
| SDF | MCULE-5346185215.sdf |
| SMILES | MCULE-5346185215.smiles |
| Standard InChI | MCULE-5346185215.inchi |
| InChIKey | MCULE-5346185215.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867546882 | 98 | As is | in stock |
| P-875703510 | N/A | As is | in stock |
| P-869186774 | 95 | As is | in stock |
| P-505351509 | 98 | As is | in stock |
| P-903028352 | 97 | As is | 300 g |
| P-905481191 | 98 | As is | 10 g |
| P-901165170 | 98 | As is | in stock |
| P-580197861 | 95 | As is | 20 g |
| P-606952413 | N/A | As is | in stock |
| P-489166501 | 97 | As is | in stock |
| P-596926547 | 97 | As is | 400 g |
| P-494321730 | 95 | As is | 58.02 g |
| P-864101135 | 95 | As is | in stock |
| P-889743714 | 95 | As is | 20 g |
| P-580696238 | 98 | As is | 1.222 kg |
| P-901464707 | 95 | As is | by synthesis |
| P-454618428 | 90 | As is | in stock |
| P-851258751 | 95 | As is | by synthesis |
| P-868556980 | 98 | As is | in stock |
| P-580290231 | N/A | As is | by resynthesis (? - ? days) |
| P-905329242 | 98 | As is | 115 g |
| P-861926891 | 98 | As is | 1.75097 kg |
| P-870658445 | N/A | As is | in stock |
| P-505494039 | 95 | As is | in stock |
| P-502495780 | 95 | As is | by synthesis |
| P-454282778 | 95 | As is | 90.134 g |
| P-454384274 | 95 | As is | 90.134 g |
| P-579611540 | 95 | As is | 500 g |
| P-580508490 | 97 | As is | by synthesis |
| P-852378659 | N/A | As is | in stock |
| P-904721244 | 90 | As is | in stock |
| P-888861292 | N/A | As is | in stock |
| P-500400410 | 98 | As is | by synthesis |
| P-889865102 | 95 | As is | by synthesis |
| P-498727616 | 97 | As is | 1.284 kg |
| P-502360592 | 90 | As is | in stock |
| P-906760052 | 98 | As is | by synthesis |
| P-611371950 | 90 | As is | in stock |
| P-615394639 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 189.930 |
| logP | 0.3852 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 40.46 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 41.2696 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 6 |
| Heteroatoms | 6 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |

