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DocumentationIdentifier: MM66928
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM66928 |
| SMILES |
CC=C(C)OC(CN)CN
|
| InChIKey |
QCGJRGOEAHLQKB-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.21
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142937
Similarity: 0.898
Similarity to MM142937
| Tanimoto metric | 0.898 |
|---|---|
| Cosine metric | 0.9476 |
| Dice metric | 0.9462 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265445
Similarity: 0.7719
Similarity to MM265445
| Tanimoto metric | 0.7719 |
|---|---|
| Cosine metric | 0.8717 |
| Dice metric | 0.8713 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265553
Similarity: 0.7672
Similarity to MM265553
| Tanimoto metric | 0.7672 |
|---|---|
| Cosine metric | 0.8691 |
| Dice metric | 0.8683 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+540 more
