MCULE-2985924234-0
- 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 | 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-2985924234-0.sdf |
| SMILES | MCULE-2985924234-0.smiles |
| Standard InChI | MCULE-2985924234-0.inchi |
| InChIKey | MCULE-2985924234-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867564931 | 98 | As is | in stock |
| P-875723866 | N/A | As is | in stock |
| P-535626398 | 95 | As is | in stock |
| P-505388613 | 98 | As is | in stock |
| P-869273337 | 99 | As is | in stock |
| P-903053080 | 98 | As is | 1.5 kg |
| P-606909191 | N/A | As is | in stock |
| P-489124176 | 97 | As is | in stock |
| P-596946422 | 98 | As is | 9 kg |
| P-866721739 | 95 | As is | by resynthesis (? - ? days) |
| P-864147611 | 97 | As is | in stock |
| P-590610212 | 98 | As is | 1.815 kg |
| P-901455511 | 95 | As is | by synthesis |
| P-505572525 | 98 | As is | in stock |
| P-868592123 | 98 | As is | in stock |
| P-905331096 | 97 | As is | 400 g |
| P-861943117 | 97 | As is | 21.9414 kg |
| P-870653889 | N/A | As is | in stock |
| P-505491273 | 95 | As is | in stock |
| P-524164232 | 98 | As is | 100 g |
| P-579615789 | 97 | As is | 2 kg |
| P-31196892 | 90 | As is | unavailable |
| P-855386905 | 95 | As is | by synthesis |
| P-854724319 | 95 | As is | in stock |
| P-500374513 | 98 | As is | by synthesis |
| P-885545675 | 95 | As is | by synthesis |
| P-498642088 | 95 | As is | by synthesis |
| P-596765843 | 95 | As is | 3.28 kg |
| P-502372475 | 90 | As is | in stock |
| P-22520810 | 90 | As is | 1000 mg |
| P-854977386 | 90 | As is | in stock |
| P-480937681 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 206.238 |
| logP | 3.3532 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 17.07 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 67.724 |
| Atoms | 26 |
| Rings | 3 |
| Heavy atoms | 16 |
| Hydrogen atoms | 10 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| 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 |

