MCULE-4915329170
- 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 | 5 USD | 95 | 10 working days | Get Quote |
| 5 mg | 5 USD | 95 | 10 working days | Get Quote |
| 10 mg | 5 USD | 95 | 10 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-4915329170.sdf |
| SMILES | MCULE-4915329170.smiles |
| Standard InChI | MCULE-4915329170.inchi |
| InChIKey | MCULE-4915329170.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867565823 | 98 | As is | in stock |
| P-875725501 | N/A | As is | in stock |
| P-535625629 | 95 | As is | in stock |
| P-505393061 | 98 | As is | in stock |
| P-903054652 | 99 | As is | 1.5 kg |
| P-905481224 | 97 | As is | 100 g |
| P-901165138 | 98 | As is | in stock |
| P-580199667 | 95 | As is | 8 g |
| P-606925222 | N/A | As is | in stock |
| P-851952582 | N/A | As is | in stock |
| P-489145629 | 97 | As is | in stock |
| P-596929127 | 99 | As is | 1000 g |
| P-872728360 | 98 | As is | in stock |
| P-494346540 | 95 | As is | 2.9 g |
| P-864106949 | 98 | As is | in stock |
| P-481169617 | 95 | As is | 5 g |
| P-580715783 | 98 | As is | 250 g |
| P-851258607 | 95 | As is | by synthesis |
| P-861271251 | 95 | As is | in stock |
| P-868577594 | 98 | As is | in stock |
| P-580282318 | N/A | As is | by resynthesis (? - ? days) |
| P-579720499 | N/A | As is | by resynthesis (? - ? days) |
| P-579802885 | 90 | As is | in stock |
| P-905335794 | 97 | As is | 666 g |
| P-861983484 | 97 | As is | 666 g |
| P-870656165 | N/A | As is | in stock |
| P-890204433 | 90 | As is | 79.97 g |
| P-579484030 | 90 | As is | 79.97 g |
| P-505524550 | 95 | As is | in stock |
| P-580044848 | 90 | As is | in stock |
| P-580006330 | 95 | As is | in stock |
| P-13877379 | 90 | As is | in stock |
| P-18813159 | 97 | As is | 4.744 g |
| P-454402919 | 97 | As is | 500 g |
| P-579624067 | 95 | As is | 500 g |
| P-31197201 | 90 | As is | 1000 mg |
| P-856041441 | 90 | As is | 1000 mg |
| P-613284665 | 95 | As is | by synthesis |
| P-580476283 | N/A | As is | by synthesis |
| P-852443544 | N/A | As is | in stock |
| P-428001678 | 95 | As is | 692 g |
| P-904059644 | 95 | As is | by synthesis |
| P-854690684 | 95 | As is | in stock |
| P-619672586 | 98 | As is | in stock |
| P-26433557 | 90 | As is | 500 mg |
| P-492279875 | 95 | As is | 5.969 g |
| P-888861335 | N/A | As is | in stock |
| P-454373937 | 92 | As is | in stock |
| P-500400051 | 98 | As is | by synthesis |
| P-885544806 | 95 | As is | by synthesis |
| P-519886605 | 90 | As is | in stock |
| P-617403301 | N/A | As is | in stock |
| P-896077357 | N/A | As is | 5.435 g |
| P-613816824 | 95 | As is | in stock |
| P-498720395 | 97 | As is | 7.58429 kg |
| P-502329702 | 90 | As is | in stock |
| P-906776444 | 99 | As is | by synthesis |
| P-611511266 | 90 | As is | in stock |
| P-575312819 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 111.099 |
| logP | 0.7129 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 53.09 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 27.752 |
| Atoms | 13 |
| Rings | 1 |
| Heavy atoms | 8 |
| 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 |

