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DocumentationIdentifier: MM184514
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM184514 |
| SMILES |
CC1NC1CC(N)CN
|
| InChIKey |
FHEUJICWXUKSIQ-UHFFFAOYSA-N
|
| MW [Da] |
129.21
Automatically obtained from RDkit software. |
| LogP |
-0.98
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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MM194148
Similarity: 0.8333
Similarity to MM194148
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9091 |
| Dice metric | 0.9091 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM109677
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| Tanimoto metric | 0.7652 |
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| Cosine metric | 0.8748 |
| Dice metric | 0.867 |
| MW: | 114.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM438438
Similarity: 0.7616
Similarity to MM438438
| Tanimoto metric | 0.7616 |
|---|---|
| Cosine metric | 0.8727 |
| Dice metric | 0.8647 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+263 more
