MCULE-1752034684
- 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 | 95 | 22 working days | Get Quote |
| 5 mg | 6 USD | 95 | 22 working days | Get Quote |
| 10 mg | 6 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.
-
MCULE-9614200331
- Component type: Main
-
MCULE-5557502815
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1752034684.sdf |
| SMILES | MCULE-1752034684.smiles |
| Standard InChI | MCULE-1752034684.inchi |
| InChIKey | MCULE-1752034684.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867586159 | 95 | As is | in stock |
| P-875745238 | N/A | As is | in stock |
| P-505390847 | 90 | As is | in stock |
| P-869254584 | 95 | As is | in stock |
| P-903076003 | 85 | As is | 11 kg |
| P-905478460 | 98 | As is | 100 g |
| P-580236003 | 95 | As is | by synthesis |
| P-851948939 | N/A | As is | in stock |
| P-606856286 | N/A | As is | in stock |
| P-489198249 | 97 | As is | in stock |
| P-865910391 | 85 | As is | 77 kg |
| P-864158972 | 98 | As is | in stock |
| P-860055066 | 98 | As is | by synthesis |
| P-619604799 | 90 | As is | 150 g |
| P-580697516 | 85 | As is | 1.635 kg |
| P-901413698 | 95 | As is | in stock |
| P-448677917 | 90 | As is | 1.901 g |
| P-881633722 | 98 | As is | in stock |
| P-425206232 | 90 | As is | in stock |
| P-868613144 | 95 | As is | in stock |
| P-905346692 | 90 | As is | 4.033 kg |
| P-862031577 | 90 | As is | 4.033 kg |
| P-870655357 | 85 | As is | in stock |
| P-890849593 | 95 | As is | in stock |
| P-488543274 | 90 | As is | in stock |
| P-13988977 | 95 | As is | 300 mg |
| P-856009550 | 97 | As is | 100 mg |
| P-889738038 | 95 | As is | unavailable |
| P-856011828 | 90 | As is | 10 g |
| P-588250226 | 85 | As is | by synthesis |
| P-852606743 | N/A | As is | in stock |
| P-1263157954 | 95 | As is | by synthesis |
| P-854693339 | 95 | As is | in stock |
| P-619673516 | 98 | As is | in stock |
| P-454363560 | 92 | As is | in stock |
| P-674415535 | 92 | As is | 300 mg |
| P-885528007 | 95 | As is | by synthesis |
| P-424905004 | 90 | As is | in stock |
| P-617402842 | N/A | As is | in stock |
| P-594274980 | 95 | As is | by synthesis |
| P-869177866 | 95 | As is | in stock |
| P-892296314 | 95 | As is | unavailable |
| P-892338697 | 95 | As is | 99.733 g |
| P-502369063 | 90 | As is | in stock |
| P-33715246 | 94 | As is | by resynthesis (? - ? days) |
| P-906758049 | 85 | As is | by synthesis |
| P-611524176 | 90 | As is | in stock |
| P-464680598 | 90 | As is | 3.432 g |
| P-3025889 | 90 | As is | 3.432 g |
| P-666975931 | 95 | As is | in stock |
| P-893165759 | N/A | As a main component | by synthesis |
| P-889907111 | N/A | As a main component | by synthesis |
| P-903079834 | 95 | As a main component | 2 g |
| P-893590738 | 90 | As a main component | 1.5 g |
| P-851644576 | N/A | As a main component | by synthesis |
| P-596931825 | 95 | As a main component | 250 mg |
| P-864152083 | 95 | As a main component | in stock |
| P-590873956 | 95 | As a main component | by synthesis |
| P-596563167 | 95 | As a main component | 1000 mg |
| P-575318031 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 340.583 |
| logP | 7.8929 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 20 |
| PSA | 37.3 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 109.6398 |
| Atoms | 68 |
| Rings | 0 |
| Heavy atoms | 24 |
| Hydrogen atoms | 44 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |

