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DocumentationIdentifier: MM184519
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM184519 |
| SMILES |
CNC(C)CC1NC1C
|
| InChIKey |
XRTHVEPYRAUXMX-UHFFFAOYSA-N
|
| MW [Da] |
128.22
Automatically obtained from RDkit software. |
| LogP |
0.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM438434
Similarity: 0.8603
Similarity to MM438434
| Tanimoto metric | 0.8603 |
|---|---|
| Cosine metric | 0.9275 |
| Dice metric | 0.9249 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM318790
Similarity: 0.8417
Similarity to MM318790
| Tanimoto metric | 0.8417 |
|---|---|
| Cosine metric | 0.9175 |
| Dice metric | 0.9141 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.69 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM438438
Similarity: 0.7748
Similarity to MM438438
| Tanimoto metric | 0.7748 |
|---|---|
| Cosine metric | 0.8802 |
| Dice metric | 0.8731 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+241 more
