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DocumentationIdentifier: MM342940
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM342940 |
| SMILES |
C=CC(=CF)CCC(=N)N
|
| InChIKey |
ZMEDTPBJHDQJPX-UHFFFAOYSA-N
|
| MW [Da] |
142.18
Automatically obtained from RDkit software. |
| LogP |
1.74
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM251584
Similarity: 0.7323
Similarity to MM251584
| Tanimoto metric | 0.7323 |
|---|---|
| Cosine metric | 0.8463 |
| Dice metric | 0.8455 |
| MW: | 142.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM145085
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| Tanimoto metric | 0.7043 |
|---|---|
| Cosine metric | 0.8393 |
| Dice metric | 0.8265 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.44 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM342285
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Similarity to MM342285
| Tanimoto metric | 0.687 |
|---|---|
| Cosine metric | 0.8152 |
| Dice metric | 0.8145 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+362 more
