MCULE-3677915339
- 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 | 4 USD | 95 | 22 working days | Get Quote |
| 5 mg | 4 USD | 95 | 22 working days | Get Quote |
| 10 mg | 4 USD | 95 | 22 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-3677915339.sdf |
| SMILES | MCULE-3677915339.smiles |
| Standard InChI | MCULE-3677915339.inchi |
| InChIKey | MCULE-3677915339.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867565399 | 95 | As is | in stock |
| P-875724874 | N/A | As is | in stock |
| P-869193303 | 95 | As is | in stock |
| P-869278904 | 99 | As is | in stock |
| P-505395109 | 98 | As is | in stock |
| P-903054054 | 98 | As is | 100 g |
| P-606931813 | N/A | As is | in stock |
| P-489136848 | 97 | As is | in stock |
| P-596928958 | 98 | As is | 6 kg |
| P-872728281 | 98 | As is | in stock |
| P-866726234 | 95 | As is | 539.85 g |
| P-864085615 | 98 | As is | in stock |
| P-893232888 | 95 | As is | in stock |
| P-872779944 | 95 | As is | by synthesis |
| P-868649853 | 98 | As is | in stock |
| P-580435040 | 95 | As is | by resynthesis (? - ? days) |
| P-861928127 | 99 | As is | 8.94746 kg |
| P-588281391 | 99 | As is | in stock |
| P-870662854 | 98 | As is | in stock |
| P-502806657 | 90 | As is | in stock |
| P-454317008 | 95 | As is | 100 mg |
| P-454400848 | 95 | As is | 25 g |
| P-579615560 | 95 | As is | 1000 g |
| P-613284516 | 95 | As is | by synthesis |
| P-580510738 | 99 | As is | 1.53708 kg |
| P-852505154 | N/A | As is | in stock |
| P-865621540 | 95 | As is | in stock |
| P-619672554 | 98 | As is | in stock |
| P-13021984 | 90 | As is | 35 mg |
| P-500401922 | 98 | As is | by synthesis |
| P-885560244 | 95 | As is | by synthesis |
| P-892252773 | 95 | As is | by synthesis |
| P-869177241 | 95 | As is | in stock |
| P-892295331 | 95 | As is | 1.213 g |
| P-892337733 | 95 | As is | 1.213 g |
| P-33803082 | 90 | As is | in stock |
| P-611375845 | 90 | As is | in stock |
| P-588734507 | N/A | As is | by synthesis |
| P-666971267 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 97.072 |
| logP | -0.4722 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 46.17 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 25.8707 |
| Atoms | 10 |
| Rings | 1 |
| Heavy atoms | 7 |
| Hydrogen atoms | 3 |
| 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 |

