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DocumentationIdentifier: MM265162
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM265162 |
| SMILES |
C=CCC(=N)NC(C)=CC
|
| InChIKey |
BVXMLNDCCCZSLO-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.05
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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MM143105
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Similarity to MM143105
| Tanimoto metric | 0.8095 |
|---|---|
| Cosine metric | 0.8997 |
| Dice metric | 0.8947 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM135635
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| Tanimoto metric | 0.7619 |
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| Cosine metric | 0.8729 |
| Dice metric | 0.8649 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.66 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM265064
Similarity: 0.731
Similarity to MM265064
| Tanimoto metric | 0.731 |
|---|---|
| Cosine metric | 0.8446 |
| Dice metric | 0.8446 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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