Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6207378439
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 | 11 USD | 95 | 8 working days | Get Quote |
| 5 mg | 11 USD | 95 | 8 working days | Get Quote |
| 10 mg | 11 USD | 95 | 8 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-6207378439.sdf |
| SMILES | MCULE-6207378439.smiles |
| Standard InChI | MCULE-6207378439.inchi |
| InChIKey | MCULE-6207378439.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-579760928 | 98 | As is | in stock |
| P-895944543 | 95 | As is | by resynthesis (? - ? days) |
| P-889740257 | 95 | As is | 160 g |
| P-454643703 | 90 | As is | in stock |
| P-619846273 | 90 | As is | 38.195 g |
| P-517097118 | 90 | As is | in stock |
| P-34742561 | 90 | As is | by synthesis |
| P-905350031 | 95 | As is | 137 g |
| P-870659243 | 98 | As is | in stock |
| P-505494791 | 95 | As is | in stock |
| P-502749037 | 90 | As is | in stock |
| P-492214895 | 95 | As is | in stock |
| P-488550553 | 90 | As is | in stock |
| P-615643788 | 95 | As is | in stock |
| P-579685688 | 95 | As is | by resynthesis (? - ? days) |
| P-579618426 | 95 | As is | unavailable |
| P-856042044 | 90 | As is | unavailable |
| P-31195887 | 90 | As is | unavailable |
| P-601075472 | 90 | As is | 213 mg |
| P-14057045 | 95 | As is | 213 mg |
| P-580516729 | 98 | As is | 130 g |
| P-852504736 | N/A | As is | in stock |
| P-895183764 | 95 | As is | in stock |
| P-871072775 | 95 | As is | in stock |
| P-12381719 | 90 | As is | 228 mg |
| P-617684615 | 90 | As is | 228 mg |
| P-454368890 | 92 | As is | in stock |
| P-885516715 | 95 | As is | by synthesis |
| P-19152373 | 90 | As is | in stock |
| P-502350138 | 90 | As is | in stock |
| P-903614848 | 94 | As is | by resynthesis (? - ? days) |
| P-855247976 | 90 | As is | in stock |
| P-3229963 | 90 | As is | 497 mg |
| P-1094175 | 90 | As is | 497 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 152.219 |
| logP | 2.1154 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 70.14 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 46.2461 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 8 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |
