MCULE-1010533153-0
- 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 | 10 USD | 98 | 20 working days | Get Quote |
| 5 mg | 10 USD | 98 | 20 working days | Get Quote |
| 10 mg | 10 USD | 98 | 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-1010533153-0.sdf |
| SMILES | MCULE-1010533153-0.smiles |
| Standard InChI | MCULE-1010533153-0.inchi |
| InChIKey | MCULE-1010533153-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867646899 | 98 | As is | in stock |
| P-875814049 | 98 | As is | in stock |
| P-869270949 | 95 | As is | by resynthesis (? - ? days) |
| P-903176202 | 98 | As is | 4 g |
| P-489202912 | 97 | As is | in stock |
| P-596970128 | 98 | As is | 5 g |
| P-1273446045 | 95 | As is | by resynthesis (? - ? days) |
| P-596511199 | 90 | As is | 1000 mg |
| P-596340466 | 90 | As is | 1000 mg |
| P-864097094 | 95 | As is | in stock |
| P-893263520 | 95 | As is | by synthesis |
| P-5179451 | 90 | As is | 16 mg |
| P-851284131 | 95 | As is | by synthesis |
| P-861503419 | 98 | As is | by synthesis |
| P-34739601 | 90 | As is | by synthesis |
| P-861944111 | 98 | As is | 16.958 g |
| P-1264335323 | 98 | As is | 1000 mg |
| P-12446438 | 92 | As is | 222 mg |
| P-524194638 | 98 | As is | 250 mg |
| P-852383503 | N/A | As is | by synthesis |
| P-1272493564 | 95 | As is | in stock |
| P-1263696888 | 95 | As is | by synthesis |
| P-621308732 | 90 | As is | by synthesis |
| P-888881194 | N/A | As is | in stock |
| P-885523122 | 95 | As is | by synthesis |
| P-19426280 | 90 | As is | in stock |
| P-666741943 | 90 | As is | 89 mg |
| P-1274334322 | 95 | As is | unavailable |
| P-1274343392 | 95 | As is | 986 mg |
| P-1274355048 | 95 | As is | 986 mg |
| P-22771523 | 90 | As is | in stock |
| P-502334757 | 90 | As is | in stock |
| P-903637596 | 94 | As is | by resynthesis (? - ? days) |
| P-611524490 | 90 | As is | in stock |
| P-25052416 | 90 | As is | 8.61 g |
| P-3224110 | 90 | As is | 8.61 g |
| P-615652424 | 95 | As is | unavailable |
| P-1271632411 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 209.284 |
| logP | 1.8152 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 41.49 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 60.9325 |
| Atoms | 34 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 19 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |

