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DocumentationIdentifier: MM314113
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM314113 |
| SMILES |
CC1(C)CN1C(CN)CN
|
| InChIKey |
FPRNWUPIVWAZNY-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
-0.63
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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MM140373
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Similarity to MM140373
| Tanimoto metric | 0.9344 |
|---|---|
| Cosine metric | 0.9667 |
| Dice metric | 0.9661 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM229956
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| Tanimoto metric | 0.8519 |
|---|---|
| Cosine metric | 0.9203 |
| Dice metric | 0.92 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM327384
Similarity: 0.7582
Similarity to MM327384
| Tanimoto metric | 0.7582 |
|---|---|
| Cosine metric | 0.8662 |
| Dice metric | 0.8625 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+225 more
