MCULE-1937699402
- 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 | 37 USD | 97 | 20 working days | Get Quote |
| 5 mg | 37 USD | 97 | 20 working days | Get Quote |
| 10 mg | 37 USD | 97 | 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-1937699402.sdf |
| SMILES | MCULE-1937699402.smiles |
| Standard InChI | MCULE-1937699402.inchi |
| InChIKey | MCULE-1937699402.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867660851 | 97 | As is | in stock |
| P-875829150 | 97 | As is | in stock |
| P-904530608 | 95 | As is | in stock |
| P-903204476 | 97 | As is | 200 g |
| P-893617641 | 90 | As is | 80 g |
| P-1263858994 | N/A | As is | in stock |
| P-873297426 | 97 | As is | 30 g |
| P-494411170 | 95 | As is | by resynthesis (? - ? days) |
| P-889792479 | 95 | As is | in stock |
| P-494302410 | 95 | As is | in stock |
| P-454685334 | 90 | As is | in stock |
| P-15151555 | 90 | As is | 34 mg |
| P-436443443 | 90 | As is | 48.985 g |
| P-330423 | 90 | As is | 937 mg |
| P-907301897 | 95 | As is | by synthesis |
| P-868620246 | 95 | As is | in stock |
| P-34726678 | 90 | As is | by synthesis |
| P-580787998 | 90 | As is | by resynthesis (? - ? days) |
| P-580438676 | 95 | As is | by resynthesis (? - ? days) |
| P-862118139 | 97 | As is | 30 g |
| P-502534118 | 95 | As is | by synthesis |
| P-899783467 | 97 | As is | 5 g |
| P-895867153 | 95 | As is | by synthesis |
| P-864072890 | 95 | As is | by synthesis |
| P-12833559 | 90 | As is | 855 mg |
| P-492283423 | 90 | As is | 855 mg |
| P-491125813 | 95 | As is | by synthesis |
| P-23844000 | 90 | As is | in stock |
| P-33482567 | 90 | As is | in stock |
| P-502337526 | 90 | As is | in stock |
| P-22559040 | 90 | As is | 1 mg |
| P-611435590 | 90 | As is | in stock |
| P-1407062 | 90 | As is | 110 mg |
| P-886902700 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 187.237 |
| logP | 2.8656 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 33.12 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 58.664 |
| Atoms | 27 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 13 |
| 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 |

