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DocumentationIdentifier: MM149902
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM149902 |
| SMILES |
CCC(CC(=N)N)NC
|
| InChIKey |
VOSWRCBRKSZQSZ-UHFFFAOYSA-N
|
| MW [Da] |
129.21
Automatically obtained from RDkit software. |
| LogP |
0.31
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM272237
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| Tanimoto metric | 0.8131 |
|---|---|
| Cosine metric | 0.9017 |
| Dice metric | 0.8969 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Cosine metric | 0.8774 |
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.56 |
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|---|---|---|---|---|---|
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MM328531
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Similarity to MM328531
| Tanimoto metric | 0.7699 |
|---|---|
| Cosine metric | 0.8774 |
| Dice metric | 0.87 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
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|
+359 more
