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DocumentationIdentifier: MM372784
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM372784 |
| SMILES |
CN(C=O)CC=CCCN
|
| InChIKey |
UNNRUNIJJHNLSY-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
-0.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM168307
Similarity: 0.9028
Similarity to MM168307
| Tanimoto metric | 0.9028 |
|---|---|
| Cosine metric | 0.9501 |
| Dice metric | 0.9489 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM372940
Similarity: 0.8125
Similarity to MM372940
| Tanimoto metric | 0.8125 |
|---|---|
| Cosine metric | 0.8966 |
| Dice metric | 0.8966 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM372782
Similarity: 0.8025
Similarity to MM372782
| Tanimoto metric | 0.8025 |
|---|---|
| Cosine metric | 0.8905 |
| Dice metric | 0.8904 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+318 more
