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DocumentationIdentifier: MM419103
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM419103 |
| SMILES |
CCCNCCC1CN1C
|
| InChIKey |
NCHHBCUGQXOUPX-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM195362
Similarity: 0.9785
Similarity to MM195362
| Tanimoto metric | 0.9785 |
|---|---|
| Cosine metric | 0.9892 |
| Dice metric | 0.9891 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM419108
Similarity: 0.9192
Similarity to MM419108
| Tanimoto metric | 0.9192 |
|---|---|
| Cosine metric | 0.9581 |
| Dice metric | 0.9579 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM419355
Similarity: 0.8426
Similarity to MM419355
| Tanimoto metric | 0.8426 |
|---|---|
| Cosine metric | 0.9165 |
| Dice metric | 0.9146 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+264 more
