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DocumentationIdentifier: MM255197
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM255197 |
| SMILES |
C=C(F)C(=C)CCN(C)C
|
| InChIKey |
ISXTUZVGSPDYAW-UHFFFAOYSA-N
|
| MW [Da] |
143.21
Automatically obtained from RDkit software. |
| LogP |
1.98
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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MM96191
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Similarity to MM96191
| Tanimoto metric | 0.8584 |
|---|---|
| Cosine metric | 0.9265 |
| Dice metric | 0.9238 |
| MW: | 129.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM302631
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| Tanimoto metric | 0.7638 |
|---|---|
| Cosine metric | 0.8661 |
| Dice metric | 0.8661 |
| MW: | 143.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.03 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM302842
Similarity: 0.7293
Similarity to MM302842
| Tanimoto metric | 0.7293 |
|---|---|
| Cosine metric | 0.8436 |
| Dice metric | 0.8435 |
| MW: | 142.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+223 more
