MCULE-1607245203-0
- 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.
-
1
MCULE-5133077095-0
- Component type: Counter Ion
-
1
MCULE-3121720910-0
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-1607245203-0.sdf |
| SMILES | MCULE-1607245203-0.smiles |
| Standard InChI | MCULE-1607245203-0.inchi |
| InChIKey | MCULE-1607245203-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867573067 | 98 | As is | in stock |
| P-875734048 | N/A | As is | in stock |
| P-869192300 | 95 | As is | in stock |
| P-579760465 | 98 | As is | in stock |
| P-903063821 | 98 | As is | 1.5 kg |
| P-893575225 | 90 | As is | 8.46291 kg |
| P-606920206 | N/A | As is | in stock |
| P-489223433 | 97 | As is | in stock |
| P-596950411 | 98 | As is | 2.5 kg |
| P-494310679 | 95 | As is | by resynthesis (? - ? days) |
| P-864184416 | 95 | As is | in stock |
| P-584629968 | 98 | As is | 157 g |
| P-868613497 | 98 | As is | in stock |
| P-580296466 | 95 | As is | by resynthesis (? - ? days) |
| P-861924783 | 98 | As is | 4.04801 kg |
| P-596585395 | 95 | As is | 500 g |
| P-608111752 | 98 | As is | 2 kg |
| P-31258784 | 90 | As is | unavailable |
| P-580516184 | 95 | As is | 780 g |
| P-852381311 | N/A | As is | in stock |
| P-854738261 | 95 | As is | in stock |
| P-885536111 | 95 | As is | by synthesis |
| P-904095526 | 98 | As is | 782 g |
| P-906760240 | 98 | As is | by synthesis |
| P-611453002 | 90 | As is | in stock |
| P-575305915 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 260.237 |
| logP | 1.4647 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 74.39 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 49.8884 |
| Atoms | 27 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 11 |
| Heteroatoms | 9 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |

