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DocumentationIdentifier: MM364895
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM364895 |
| SMILES |
C=C(C(C)O)C(C)CC
|
| InChIKey |
GRUXSTSKVNXLHC-UHFFFAOYSA-N
|
| MW [Da] |
128.22
Automatically obtained from RDkit software. |
| LogP |
1.97
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM375510
Similarity: 0.8051
Similarity to MM375510
| Tanimoto metric | 0.8051 |
|---|---|
| Cosine metric | 0.8973 |
| Dice metric | 0.892 |
| MW: | 142.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM373922
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| Tanimoto metric | 0.7787 |
|---|---|
| Cosine metric | 0.8824 |
| Dice metric | 0.8756 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.14 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM390172
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Similarity to MM390172
| Tanimoto metric | 0.7787 |
|---|---|
| Cosine metric | 0.8824 |
| Dice metric | 0.8756 |
| MW: | 142.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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