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DocumentationIdentifier: MM236901
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM236901 |
| SMILES |
C=C(C)NC(=O)CCCC
|
| InChIKey |
HCYJTJWJOGKLQI-UHFFFAOYSA-N
|
| MW [Da] |
141.21
Automatically obtained from RDkit software. |
| LogP |
1.83
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM135521
Similarity: 0.8559
Similarity to MM135521
| Tanimoto metric | 0.8559 |
|---|---|
| Cosine metric | 0.9251 |
| Dice metric | 0.9223 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM237014
Similarity: 0.7698
Similarity to MM237014
| Tanimoto metric | 0.7698 |
|---|---|
| Cosine metric | 0.87 |
| Dice metric | 0.87 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM236902
Similarity: 0.7661
Similarity to MM236902
| Tanimoto metric | 0.7661 |
|---|---|
| Cosine metric | 0.8677 |
| Dice metric | 0.8676 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+461 more
