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DocumentationIdentifier: MM61085
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM61085 |
| SMILES |
C=C(C)CNCCC(C)=O
|
| InChIKey |
GFZMGWJLQIWGEI-UHFFFAOYSA-N
|
| MW [Da] |
141.21
Automatically obtained from RDkit software. |
| LogP |
1.13
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM56211
Similarity: 0.8228
Similarity to MM56211
| Tanimoto metric | 0.8228 |
|---|---|
| Cosine metric | 0.9071 |
| Dice metric | 0.9028 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM365090
Similarity: 0.7528
Similarity to MM365090
| Tanimoto metric | 0.7528 |
|---|---|
| Cosine metric | 0.859 |
| Dice metric | 0.859 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM365010
Similarity: 0.7528
Similarity to MM365010
| Tanimoto metric | 0.7528 |
|---|---|
| Cosine metric | 0.859 |
| Dice metric | 0.859 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+757 more
