MCULE-9971793748-0
- 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 | 7 USD | 97 | 20 working days | Get Quote |
| 5 mg | 7 USD | 97 | 20 working days | Get Quote |
| 10 mg | 7 USD | 97 | 20 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-9185702577-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9971793748-0.sdf |
| SMILES | MCULE-9971793748-0.smiles |
| Standard InChI | MCULE-9971793748-0.inchi |
| InChIKey | MCULE-9971793748-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-893579333 | 90 | As is | 905.546 g |
| P-856054151 | 95 | As is | by synthesis |
| P-617068040 | N/A | As is | in stock |
| P-606920881 | N/A | As is | in stock |
| P-596947617 | 95 | As is | 200 g |
| P-596965600 | 97 | As is | 2 kg |
| P-895922812 | 95 | As is | by resynthesis (? - ? days) |
| P-869449827 | 90 | As is | 48 mg |
| P-864116793 | 95 | As is | in stock |
| P-580709258 | 95 | As is | 232 g |
| P-454626099 | 90 | As is | in stock |
| P-505609986 | 97 | As is | by synthesis |
| P-436452900 | 95 | As is | 67 g |
| P-19868755 | 90 | As is | in stock |
| P-861272112 | 95 | As is | in stock |
| P-868580250 | 97 | As is | in stock |
| P-580288283 | N/A | As is | by resynthesis (? - ? days) |
| P-579483142 | 90 | As is | 3.562 g |
| P-890203674 | 90 | As is | in stock |
| P-502449244 | 95 | As is | by synthesis |
| P-502683642 | 90 | As is | in stock |
| P-492216527 | 95 | As is | in stock |
| P-488546379 | 90 | As is | in stock |
| P-13329703 | 95 | As is | 300 mg |
| P-579628654 | 96 | As is | 50 g |
| P-856012307 | 90 | As is | 2 g |
| P-601054721 | 90 | As is | 250 mg |
| P-14055443 | 95 | As is | 250 mg |
| P-852552528 | N/A | As is | in stock |
| P-863709586 | 95 | As is | in stock |
| P-12974285 | 90 | As is | 42 mg |
| P-454366195 | 92 | As is | in stock |
| P-23802868 | 92 | As is | 300 mg |
| P-613816717 | 95 | As is | in stock |
| P-888431415 | 94 | As is | by resynthesis (? - ? days) |
| P-888433135 | 94 | As is | by resynthesis (? - ? days) |
| P-906777247 | 97 | As is | by synthesis |
| P-3244359 | 90 | As is | 1.369 g |
| P-893996622 | 95 | As is | in stock |
| P-851666035 | N/A | As a main component | by synthesis |
| P-590988537 | 95 | As a main component | by synthesis |
| P-878236031 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 126.113 |
| logP | 0.4163 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 65.98 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 30.513 |
| Atoms | 15 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 6 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |

