MCULE-3981946195
- 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.
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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.
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1 mg | 37 USD | N/A | 10 working days | Get Quote |
5 mg | 50 USD | 95 | 11 working days | Get Quote |
10 mg | 87 USD | 95 | 11 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-3981946195.sdf |
SMILES | MCULE-3981946195.smiles |
Standard InChI | MCULE-3981946195.inchi |
InChIKey | MCULE-3981946195.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867616877 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
P-875778180 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869373688 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-505394182 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-868817452 | AmBeed | On request | N/A | As is | by synthesis |
P-889498445 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-868079096 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
P-888658221 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
P-594275658 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
P-855355522 | Toronto Research | In stock | 90 | As is | in stock |
P-886932322 | eNovation Chemicals LLC | Building Block on demand | 98 | As is | by synthesis |
Property | Value |
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Components | 1 |
Mass | 446.501 |
logP | 2.1358 |
H-bond acceptors | 9 |
H-bond donors | 1 |
Rotatable bonds | 4 |
PSA | 106.14 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 129.7228 |
Atoms | 59 |
Rings | 5 |
Heavy atoms | 33 |
Hydrogen atoms | 26 |
Heteroatoms | 9 |
N/O atoms | 9 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 1 |
R/S chiral centers | 1 |
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 |