MCULE-4124828434
- 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 | 20 USD | 98 | 20 working days | Get Quote |
| 5 mg | 20 USD | 98 | 20 working days | Get Quote |
| 10 mg | 20 USD | 98 | 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.
| Name | File |
|---|---|
| SDF | MCULE-4124828434.sdf |
| SMILES | MCULE-4124828434.smiles |
| Standard InChI | MCULE-4124828434.inchi |
| InChIKey | MCULE-4124828434.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867593854 | 95 | As is | in stock |
| P-875752645 | N/A | As is | in stock |
| P-890249501 | 97 | As is | by synthesis |
| P-597016313 | 95 | As is | in stock |
| P-590400868 | 95 | As is | in stock |
| P-903085434 | 96 | As is | 30 g |
| P-610954079 | 90 | As is | 102.027 g |
| P-856059860 | 95 | As is | by synthesis |
| P-617049651 | 95 | As is | by resynthesis (? - ? days) |
| P-851930947 | N/A | As is | in stock |
| P-489195499 | 97 | As is | in stock |
| P-596979322 | 98 | As is | 30 g |
| P-864098960 | 95 | As is | in stock |
| P-600956334 | 95 | As is | by synthesis |
| P-600956335 | 95 | As is | by synthesis |
| P-851248473 | 95 | As is | by synthesis |
| P-861267592 | 95 | As is | in stock |
| P-868598054 | 97 | As is | in stock |
| P-580422591 | 95 | As is | by resynthesis (? - ? days) |
| P-905359244 | 95 | As is | 250 mg |
| P-905345834 | 95 | As is | 250 mg |
| P-454301129 | 97 | As is | 47.156 g |
| P-454392990 | 97 | As is | 47.156 g |
| P-579618509 | 95 | As is | unavailable |
| P-860796649 | 95 | As is | 5 g |
| P-852438837 | N/A | As is | in stock |
| P-854751575 | 95 | As is | in stock |
| P-888858275 | N/A | As is | in stock |
| P-889881580 | 95 | As is | by synthesis |
| P-579704916 | N/A | As is | in stock |
| P-613814998 | 95 | As is | in stock |
| P-498701774 | 97 | As is | 57.52 g |
| P-611371609 | 90 | As is | in stock |
| P-480946566 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 143.145 |
| logP | 1.43458 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 52.47 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 40.8087 |
| Atoms | 16 |
| Rings | 2 |
| Heavy atoms | 11 |
| Hydrogen atoms | 5 |
| 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 |

