Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3431951803
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 6 USD | 97 | 14 working days | Get Quote |
| 5 mg | 6 USD | 97 | 14 working days | Get Quote |
| 10 mg | 6 USD | 97 | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-3431951803.sdf |
| SMILES | MCULE-3431951803.smiles |
| Standard InChI | MCULE-3431951803.inchi |
| InChIKey | MCULE-3431951803.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867593261 | 97 | As is | in stock |
| P-875752201 | N/A | As is | in stock |
| P-505397846 | 98 | As is | in stock |
| P-903084517 | 97 | As is | 110 g |
| P-905482889 | 97 | As is | 10 g |
| P-610953096 | 90 | As is | 5.2342 kg |
| P-901164570 | 97 | As is | in stock |
| P-580240729 | 95 | As is | by synthesis |
| P-606910852 | N/A | As is | in stock |
| P-489143730 | 97 | As is | in stock |
| P-596956524 | 97 | As is | 100 g |
| P-494352882 | 95 | As is | 46 g |
| P-864106415 | 95 | As is | in stock |
| P-580718396 | 97 | As is | 90.25 g |
| P-454686647 | 90 | As is | in stock |
| P-584581394 | 90 | As is | 1 mg |
| P-436443911 | 90 | As is | 6 g |
| P-340133 | 90 | As is | 473 mg |
| P-436464624 | 95 | As is | 4 g |
| P-851241466 | 95 | As is | by synthesis |
| P-861272392 | 95 | As is | in stock |
| P-868561268 | 98 | As is | in stock |
| P-34729435 | 90 | As is | in stock |
| P-580411870 | 95 | As is | by resynthesis (? - ? days) |
| P-905339075 | 95 | As is | 5 g |
| P-862000630 | 95 | As is | 293.843 g |
| P-579522226 | 90 | As is | 1 mg |
| P-890211066 | 90 | As is | in stock |
| P-505549109 | 95 | As is | in stock |
| P-500151081 | 96 | As is | in stock |
| P-588717607 | 97 | As is | 955 mg |
| P-855916814 | 97 | As is | 250 mg |
| P-524186487 | 97 | As is | 25 g |
| P-855954340 | 97 | As is | 1000 mg |
| P-608098760 | 95 | As is | 63 g |
| P-467882907 | 95 | As is | by synthesis |
| P-601047082 | 90 | As is | 4.248 g |
| P-580463680 | N/A | As is | by synthesis |
| P-852437581 | N/A | As is | in stock |
| P-854731740 | 95 | As is | in stock |
| P-888903897 | N/A | As is | in stock |
| P-500412008 | 98 | As is | by synthesis |
| P-859988631 | 95 | As is | by synthesis |
| P-24065490 | 90 | As is | in stock |
| P-579705288 | N/A | As is | in stock |
| P-851381209 | 97 | As is | 191.44 g |
| P-22625431 | 90 | As is | in stock |
| P-502337958 | 90 | As is | in stock |
| P-906905802 | 97 | As is | in stock |
| P-2144854 | 90 | As is | 110 mg |
| P-893946553 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 130.142 |
| logP | 0.4976 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 46.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 31.6988 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 10 |
| 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 |
