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DocumentationIdentifier: MM287681
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM287681 |
| SMILES |
C=CC=CCCCC(=N)N
|
| InChIKey |
MBZZUESXRAMEFB-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.83
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM152957
Similarity: 0.8667
Similarity to MM152957
| Tanimoto metric | 0.8667 |
|---|---|
| Cosine metric | 0.9309 |
| Dice metric | 0.9286 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM287573
Similarity: 0.8442
Similarity to MM287573
| Tanimoto metric | 0.8442 |
|---|---|
| Cosine metric | 0.9169 |
| Dice metric | 0.9155 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM287682
Similarity: 0.7386
Similarity to MM287682
| Tanimoto metric | 0.7386 |
|---|---|
| Cosine metric | 0.8498 |
| Dice metric | 0.8497 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+652 more
