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DocumentationIdentifier: MM386267
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM386267 |
| SMILES |
CCNC=C(C=O)OC=O
|
| InChIKey |
LWRIZVIACBAOLT-UHFFFAOYSA-N
|
| MW [Da] |
143.14
Automatically obtained from RDkit software. |
| LogP |
-0.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM179224
Similarity: 0.8136
Similarity to MM179224
| Tanimoto metric | 0.8136 |
|---|---|
| Cosine metric | 0.902 |
| Dice metric | 0.8972 |
| MW: | 129.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM67472
Similarity: 0.6154
Similarity to MM67472
| Tanimoto metric | 0.6154 |
|---|---|
| Cosine metric | 0.7634 |
| Dice metric | 0.7619 |
| MW: | 143.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM78871
Similarity: 0.4424
Similarity to MM78871
| Tanimoto metric | 0.4424 |
|---|---|
| Cosine metric | 0.6135 |
| Dice metric | 0.6134 |
| MW: | 142.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+35 more
