Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1703428892
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 | 34 USD | 95 | 20 working days | Get Quote |
| 5 mg | 100 USD | 95 | 20 working days | Get Quote |
| 10 mg | 105 USD | 98 | 11 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-1703428892.sdf |
| SMILES | MCULE-1703428892.smiles |
| Standard InChI | MCULE-1703428892.inchi |
| InChIKey | MCULE-1703428892.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875787205 | N/A | As is | in stock |
| P-613846001 | 98 | As is | in stock |
| P-903136672 | 95 | As is | 1.25 g |
| P-580235620 | 95 | As is | by synthesis |
| P-851932098 | N/A | As is | in stock |
| P-25947831 | 70 | As is | 5 mg |
| P-619199537 | 95 | As is | 1.25 g |
| P-901329346 | 98 | As is | in stock |
| P-864192001 | 95 | As is | in stock |
| P-611004511 | 95 | As is | 2.17 g |
| P-893238457 | 95 | As is | in stock |
| P-452655127 | 98 | As is | in stock |
| P-861338115 | 95 | As is | by synthesis |
| P-580272171 | 95 | As is | by resynthesis (? - ? days) |
| P-862030870 | 95 | As is | 37 mg |
| P-855960709 | 95 | As is | 250 mg |
| P-895170726 | 95 | As is | in stock |
| P-878649199 | 98 | As is | in stock |
| P-889865510 | 95 | As is | by synthesis |
| P-892278924 | 95 | As is | by synthesis |
| P-869179634 | 95 | As is | in stock |
| P-892301465 | 95 | As is | unavailable |
| P-892354243 | 95 | As is | 100 mg |
| P-33162478 | 90 | As is | 100 mg |
| P-611369929 | 90 | As is | in stock |
| P-615459850 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 270.236 |
| logP | 2.5768 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 1 |
| PSA | 90.9 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 73.989 |
| Atoms | 30 |
| Rings | 3 |
| Heavy atoms | 20 |
| Hydrogen atoms | 10 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
