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DocumentationIdentifier: MM397485
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM397485 |
| SMILES |
NC(N)=C(C=O)OCCO
|
| InChIKey |
DWMNNKYHASOHSV-UHFFFAOYSA-N
|
| MW [Da] |
146.15
Automatically obtained from RDkit software. |
| LogP |
-1.72
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM180882
Similarity: 0.8364
Similarity to MM180882
| Tanimoto metric | 0.8364 |
|---|---|
| Cosine metric | 0.9145 |
| Dice metric | 0.9109 |
| MW: | 130.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM397549
Similarity: 0.7561
Similarity to MM397549
| Tanimoto metric | 0.7561 |
|---|---|
| Cosine metric | 0.8613 |
| Dice metric | 0.8611 |
| MW: | 144.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM276218
Similarity: 0.7023
Similarity to MM276218
| Tanimoto metric | 0.7023 |
|---|---|
| Cosine metric | 0.8252 |
| Dice metric | 0.8251 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+227 more
