MCULE-7124693105-0
- 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.
-
1
MCULE-8914358370-0
- Component type: Main
-
1
MCULE-7245694496-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7124693105-0.sdf |
| SMILES | MCULE-7124693105-0.smiles |
| Standard InChI | MCULE-7124693105-0.inchi |
| InChIKey | MCULE-7124693105-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867607701 | 97 | As is | in stock |
| P-875766389 | 97 | As is | in stock |
| P-1275181411 | 99 | As is | in stock |
| P-1275154170 | 95 | As is | in stock |
| P-872728382 | 98 | As is | in stock |
| P-903104304 | 97 | As is | 100 g |
| P-1264056821 | 99 | As is | in stock |
| P-617064600 | 95 | As is | in stock |
| P-606848243 | N/A | As is | in stock |
| P-596961415 | 97 | As is | 1000 g |
| P-1273455342 | 95 | As is | by resynthesis (? - ? days) |
| P-864192172 | 95 | As is | in stock |
| P-580700436 | 97 | As is | 2.25 g |
| P-893233659 | 95 | As is | in stock |
| P-851245818 | 95 | As is | by synthesis |
| P-868647943 | 97 | As is | in stock |
| P-861972128 | 95 | As is | 499.999 g |
| P-889113274 | 95 | As is | 2 g |
| P-608220736 | 98 | As is | in stock |
| P-856009798 | 95 | As is | 100 mg |
| P-874467034 | 95 | As is | by synthesis |
| P-852521774 | 95 | As is | by synthesis |
| P-854713187 | 95 | As is | in stock |
| P-904059681 | 95 | As is | by synthesis |
| P-888172304 | 98 | As is | by synthesis |
| P-885550146 | 95 | As is | by synthesis |
| P-617402512 | 98 | As is | in stock |
| P-869163400 | 95 | As is | 2.16 g |
| P-892299510 | 95 | As is | 2.16 g |
| P-888658763 | 95 | As is | 2.16 g |
| P-1271709223 | 97 | As is | in stock |
| P-617324845 | 90 | Main component as a main component | in stock |
| P-580004935 | 95 | Main component as a main component | in stock |
| P-580008710 | 90 | Main component as a main component | in stock |
| P-895712769 | 95 | Main component as a main component | by synthesis |
| P-888592779 | 94 | Main component as a main component | by resynthesis (? - ? days) |
| P-907298548 | 94 | Main component as a main component | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 306.339 |
| logP | 2.3863 |
| H-bond acceptors | 6 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 91.58 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 79.5304 |
| Atoms | 35 |
| Rings | 3 |
| Heavy atoms | 21 |
| Hydrogen atoms | 14 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 |

