MCULE-7797350812
- 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 | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 USD | 98 | 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.
| Name | File |
|---|---|
| SDF | MCULE-7797350812.sdf |
| SMILES | MCULE-7797350812.smiles |
| Standard InChI | MCULE-7797350812.inchi |
| InChIKey | MCULE-7797350812.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867558079 | 97 | As is | in stock |
| P-875717549 | N/A | As is | in stock |
| P-869195030 | 95 | As is | in stock |
| P-505395950 | 97 | As is | in stock |
| P-903046005 | 98 | As is | 2 kg |
| P-905478183 | 97 | As is | 100 g |
| P-580238703 | 95 | As is | by synthesis |
| P-606911434 | N/A | As is | in stock |
| P-489157455 | 97 | As is | in stock |
| P-596927449 | 98 | As is | 2.5 kg |
| P-494352475 | 95 | As is | 133 g |
| P-864111547 | 97 | As is | in stock |
| P-580696609 | 97 | As is | 1.695 kg |
| P-893229046 | 95 | As is | in stock |
| P-505578423 | 96 | As is | in stock |
| P-454763327 | 90 | As is | in stock |
| P-851272292 | 95 | As is | by synthesis |
| P-868577938 | 97 | As is | in stock |
| P-34603430 | 90 | As is | by synthesis |
| P-580781754 | 90 | As is | by resynthesis (? - ? days) |
| P-580770629 | 90 | As is | in stock |
| P-580432302 | 95 | As is | by resynthesis (? - ? days) |
| P-575331661 | 95 | As is | in stock |
| P-861966437 | 97 | As is | 6.98901 kg |
| P-905333184 | 97 | As is | 85 g |
| P-505497224 | 95 | As is | in stock |
| P-855993143 | 98 | As is | 100 mg |
| P-524167817 | 98 | As is | 500 g |
| P-579614532 | 95 | As is | 5 kg |
| P-613281840 | 95 | As is | by synthesis |
| P-580512911 | 96 | As is | 115 g |
| P-852403668 | N/A | As is | in stock |
| P-854725572 | 95 | As is | in stock |
| P-596796677 | 95 | As is | by synthesis |
| P-596768238 | 95 | As is | 2.282 kg |
| P-22631146 | 90 | As is | in stock |
| P-502346933 | 90 | As is | in stock |
| P-906768916 | 95 | As is | by synthesis |
| P-611457547 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 156.179 |
| logP | 0.9187 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 5 |
| PSA | 43.37 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 39.941 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 12 |
| 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 |

