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DocumentationIdentifier: MM353466
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM353466 |
| SMILES |
C=C(OC=CC)C(C)NC
|
| InChIKey |
OIKLFQBSRBDNNY-UHFFFAOYSA-N
|
| MW [Da] |
141.21
Automatically obtained from RDkit software. |
| LogP |
1.66
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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MM162956
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Similarity to MM162956
| Tanimoto metric | 0.7377 |
|---|---|
| Cosine metric | 0.8589 |
| Dice metric | 0.8491 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Tanimoto metric | 0.6716 |
|---|---|
| Cosine metric | 0.8068 |
| Dice metric | 0.8036 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM25810
Similarity: 0.6581
Similarity to MM25810
| Tanimoto metric | 0.6581 |
|---|---|
| Cosine metric | 0.7948 |
| Dice metric | 0.7938 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+198 more
