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DocumentationIdentifier: MM210625
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM210625 |
| SMILES |
CCC(C)N1CC1CN
|
| InChIKey |
CNOQHBPCPBFXEO-UHFFFAOYSA-N
|
| MW [Da] |
128.22
Automatically obtained from RDkit software. |
| LogP |
0.43
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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MM424999
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Similarity to MM424999
| Tanimoto metric | 0.9219 |
|---|---|
| Cosine metric | 0.9601 |
| Dice metric | 0.9593 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Tanimoto metric | 0.8252 |
|---|---|
| Cosine metric | 0.9084 |
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| MW: | 142.25 |
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM442913
Similarity: 0.7973
Similarity to MM442913
| Tanimoto metric | 0.7973 |
|---|---|
| Cosine metric | 0.8929 |
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| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+277 more
