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DocumentationIdentifier: MM305191
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM305191 |
| SMILES |
N=C(N)C(CCN)CCF
|
| InChIKey |
CCOACNYVZCDLTE-UHFFFAOYSA-N
|
| MW [Da] |
147.2
Automatically obtained from RDkit software. |
| LogP |
0.25
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM179788
Similarity: 0.6937
Similarity to MM179788
| Tanimoto metric | 0.6937 |
|---|---|
| Cosine metric | 0.8329 |
| Dice metric | 0.8191 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM305189
Similarity: 0.6692
Similarity to MM305189
| Tanimoto metric | 0.6692 |
|---|---|
| Cosine metric | 0.8018 |
| Dice metric | 0.8018 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM275168
Similarity: 0.6541
Similarity to MM275168
| Tanimoto metric | 0.6541 |
|---|---|
| Cosine metric | 0.7909 |
| Dice metric | 0.7909 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+246 more
