MCULE-6294437098-2
- 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 | 12 USD | 97 | 20 working days | Get Quote |
| 5 mg | 12 USD | 97 | 20 working days | Get Quote |
| 10 mg | 12 USD | 97 | 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-3583752909-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6294437098-2.sdf |
| SMILES | MCULE-6294437098-2.smiles |
| Standard InChI | MCULE-6294437098-2.inchi |
| InChIKey | MCULE-6294437098-2.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875853894 | 97 | As a main component | in stock |
| P-872724671 | 98 | As a main component | in stock |
| P-1264047835 | 98 | As a main component | in stock |
| P-1270284640 | 97 | As a main component | in stock |
| P-851929400 | N/A | As a main component | in stock |
| P-619166155 | 97 | As a main component | 200 g |
| P-1273297595 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864188349 | 95 | As a main component | in stock |
| P-616205405 | 97 | As a main component | 30 g |
| P-901458052 | 95 | As a main component | by synthesis |
| P-851204005 | 98 | As a main component | in stock |
| P-861432173 | 95 | As a main component | by synthesis |
| P-870652505 | N/A | As a main component | in stock |
| P-675211797 | 95 | As a main component | in stock |
| P-856010120 | 97 | As a main component | 461 mg |
| P-619671410 | 98 | As a main component | in stock |
| P-617401760 | 98 | As a main component | in stock |
| P-892286286 | 95 | As a main component | unavailable |
| P-869107683 | 95 | As a main component | 144 mg |
| P-888626719 | 95 | As a main component | 144 mg |
| P-906868132 | 97 | As a main component | by synthesis |
| P-855104046 | 90 | As a main component | in stock |
| P-1271670541 | 97 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 122.981 |
| logP | -0.6162 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 113.13 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 15.062 |
| Atoms | 7 |
| Rings | 0 |
| Heavy atoms | 7 |
| Hydrogen atoms | 0 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |

