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DocumentationIdentifier: MM215200
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM215200 |
| SMILES |
O=CCOC=CC=CF
|
| InChIKey |
ISRDNRBSJMPFGJ-UHFFFAOYSA-N
|
| MW [Da] |
130.12
Automatically obtained from RDkit software. |
| LogP |
1.2
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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MM126236
Similarity: 0.7705
Similarity to MM126236
| Tanimoto metric | 0.7705 |
|---|---|
| Cosine metric | 0.8778 |
| Dice metric | 0.8704 |
| MW: | 112.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM126724
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| Tanimoto metric | 0.7705 |
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| Cosine metric | 0.8778 |
| Dice metric | 0.8704 |
| MW: | 116.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM215197
Similarity: 0.6812
Similarity to MM215197
| Tanimoto metric | 0.6812 |
|---|---|
| Cosine metric | 0.8114 |
| Dice metric | 0.8103 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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