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DocumentationIdentifier: MM100423
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM100423 |
| SMILES |
CC1CN1CCN
|
| InChIKey |
GXGFCNGGJLTRJB-UHFFFAOYSA-N
|
| MW [Da] |
100.17
Automatically obtained from RDkit software. |
| LogP |
-0.35
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM124724
Similarity: 0.8108
Similarity to MM124724
| Tanimoto metric | 0.8108 |
|---|---|
| Cosine metric | 0.9005 |
| Dice metric | 0.8955 |
| MW: | 114.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Cosine metric | 0.8771 |
| Dice metric | 0.8696 |
| MW: | 114.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.04 |
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| AI: | 0
Total active interactions
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MM192989
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| Tanimoto metric | 0.7692 |
|---|---|
| Cosine metric | 0.8771 |
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| MW: | 128.22 |
||||
|---|---|---|---|---|---|
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Total passive interactions
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| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+285 more
