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DocumentationIdentifier: MM395505
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM395505 |
| SMILES |
C=CC=CC(CC)C(=N)N
|
| InChIKey |
CHAYELRFKXRGMJ-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM180148
Similarity: 0.8403
Similarity to MM180148
| Tanimoto metric | 0.8403 |
|---|---|
| Cosine metric | 0.9167 |
| Dice metric | 0.9132 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM305756
Similarity: 0.7464
Similarity to MM305756
| Tanimoto metric | 0.7464 |
|---|---|
| Cosine metric | 0.8548 |
| Dice metric | 0.8548 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM275829
Similarity: 0.7194
Similarity to MM275829
| Tanimoto metric | 0.7194 |
|---|---|
| Cosine metric | 0.8368 |
| Dice metric | 0.8368 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+213 more
