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DocumentationIdentifier: MM377406
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM377406 |
| SMILES |
CNCC(OC)C(=N)NC
|
| InChIKey |
WBJDXTRIWZQFBG-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-0.58
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM197226
Similarity: 0.8968
Similarity to MM197226
| Tanimoto metric | 0.8968 |
|---|---|
| Cosine metric | 0.947 |
| Dice metric | 0.9456 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM179824
Similarity: 0.8175
Similarity to MM179824
| Tanimoto metric | 0.8175 |
|---|---|
| Cosine metric | 0.9041 |
| Dice metric | 0.8996 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM377432
Similarity: 0.7483
Similarity to MM377432
| Tanimoto metric | 0.7483 |
|---|---|
| Cosine metric | 0.8569 |
| Dice metric | 0.8561 |
| MW: | 145.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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