MCULE-2570139670-0
- 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 | 40 USD | 90 | 22 working days | Get Quote |
| 5 mg | 58 USD | 90 | 22 working days | Get Quote |
| 10 mg | 73 USD | 90 | 22 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-1354599703-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2570139670-0.sdf |
| SMILES | MCULE-2570139670-0.smiles |
| Standard InChI | MCULE-2570139670-0.inchi |
| InChIKey | MCULE-2570139670-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886622414 | 95 | As is | in stock |
| P-889931655 | N/A | As is | by synthesis |
| P-869345250 | 95 | As is | in stock |
| P-903165199 | 95 | As is | 1000 mg |
| P-851893373 | N/A | As is | by synthesis |
| P-591154494 | 95 | As is | by synthesis |
| P-861474755 | 95 | As is | by synthesis |
| P-613278589 | 95 | As is | by synthesis |
| P-854865600 | 95 | As is | by synthesis |
| P-855248295 | 90 | As is | in stock |
| P-893771914 | 95 | As is | by synthesis |
| P-886653267 | 95 | As a main component | in stock |
| P-889949437 | N/A | As a main component | by synthesis |
| P-869315736 | 95 | As a main component | in stock |
| P-903215389 | 95 | As a main component | 2.5 g |
| P-904030098 | N/A | As a main component | by synthesis |
| P-905573288 | 95 | As a main component | by synthesis |
| P-901481910 | 95 | As a main component | by synthesis |
| P-4146819 | 90 | As a main component | 100 mg |
| P-861388641 | 95 | As a main component | by synthesis |
| P-854856254 | 95 | As a main component | by synthesis |
| P-617768096 | 90 | As a main component | 175 mg |
| P-893869204 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 153.196 |
| logP | 2.3261 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 12.03 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 43.7817 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 12 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |

