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DocumentationIdentifier: MM152965
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM152965 |
| SMILES |
CN=CNCCC(=N)N
|
| InChIKey |
PVVVALMNIYZDIM-UHFFFAOYSA-N
|
| MW [Da] |
128.18
Automatically obtained from RDkit software. |
| LogP |
-0.44
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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MM366725
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| Tanimoto metric | 0.84 |
|---|---|
| Cosine metric | 0.9165 |
| Dice metric | 0.913 |
| MW: | 142.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM105715
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| Tanimoto metric | 0.8095 |
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| Cosine metric | 0.8997 |
| Dice metric | 0.8947 |
| MW: | 114.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.49 |
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| AI: | 0
Total active interactions
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MM258812
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Similarity to MM258812
| Tanimoto metric | 0.6848 |
|---|---|
| Cosine metric | 0.8275 |
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| MW: | 142.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+193 more
