MCULE-5124291143
- 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 | 16 USD | 97 | 17 working days | Get Quote |
| 5 mg | 16 USD | 97 | 17 working days | Get Quote |
| 10 mg | 16 USD | 97 | 17 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-4324422583
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5124291143.sdf |
| SMILES | MCULE-5124291143.smiles |
| Standard InChI | MCULE-5124291143.inchi |
| InChIKey | MCULE-5124291143.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867639798 | N/A | As is | in stock |
| P-875805566 | N/A | As is | in stock |
| P-869187831 | 95 | As is | in stock |
| P-505400548 | 98 | As is | in stock |
| P-903163704 | 95 | As is | 200 mg |
| P-893608028 | 90 | As is | 20.1 g |
| P-489144685 | 97 | As is | in stock |
| P-895101444 | 99 | As is | 20 g |
| P-494321337 | 95 | As is | 940 mg |
| P-905471198 | 95 | As is | in stock |
| P-878239962 | N/A | As is | in stock |
| P-577173781 | 90 | As is | by synthesis |
| P-3656049 | 90 | As is | 63 mg |
| P-436442566 | 90 | As is | 4.98 g |
| P-140075 | 90 | As is | 964 mg |
| P-868621117 | 97 | As is | in stock |
| P-34679377 | 90 | As is | by synthesis |
| P-580787529 | 90 | As is | by resynthesis (? - ? days) |
| P-575335803 | 95 | As is | in stock |
| P-905308876 | 97 | As is | 5.5 g |
| P-454297358 | 90 | As is | 138 mg |
| P-31187901 | 90 | As is | 200 mg |
| P-888726678 | 97 | As is | by synthesis |
| P-852378244 | N/A | As is | in stock |
| P-519749906 | 97 | As is | 8.7 g |
| P-35164859 | 97 | As is | 972 g |
| P-895274925 | 95 | As is | by synthesis |
| P-491225587 | 95 | As is | by synthesis |
| P-892254194 | 95 | As is | by synthesis |
| P-892296604 | 95 | As is | unavailable |
| P-892338991 | 95 | As is | 1.21 g |
| P-502337063 | 90 | As is | in stock |
| P-22492700 | 90 | As is | 159 mg |
| P-611369564 | 90 | As is | in stock |
| P-886946295 | 95 | As is | by synthesis |
| P-886662522 | 95 | As a main component | in stock |
| P-889965298 | N/A | As a main component | by synthesis |
| P-869301597 | 95 | As a main component | in stock |
| P-903228227 | 95 | As a main component | 2.5 g |
| P-851476945 | N/A | As a main component | by synthesis |
| P-611022512 | 95 | As a main component | by synthesis |
| P-4794812 | 90 | As a main component | 10 mg |
| P-861386376 | 95 | As a main component | by synthesis |
| P-854845662 | 95 | As a main component | by synthesis |
| P-675079112 | 90 | As a main component | in stock |
| P-617712962 | 90 | As a main component | 2.989 g |
| P-617740394 | 90 | As a main component | 2.989 g |
| P-893782430 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 275.227 |
| logP | 2.9402 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 61.09 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 71.6247 |
| Atoms | 31 |
| Rings | 2 |
| Heavy atoms | 19 |
| Hydrogen atoms | 12 |
| Heteroatoms | 8 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |

