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DocumentationIdentifier: MM307765
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM307765 |
| SMILES |
COCCC(O)(CO)CO
|
| InChIKey |
YXVPBUKOAKPWNC-UHFFFAOYSA-N
|
| MW [Da] |
150.17
Automatically obtained from RDkit software. |
| LogP |
-1.26
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM41800
Similarity: 0.8636
Similarity to MM41800
| Tanimoto metric | 0.8636 |
|---|---|
| Cosine metric | 0.9293 |
| Dice metric | 0.9268 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM139192
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| Tanimoto metric | 0.7727 |
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| Cosine metric | 0.879 |
| Dice metric | 0.8718 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM242973
Similarity: 0.7685
Similarity to MM242973
| Tanimoto metric | 0.7685 |
|---|---|
| Cosine metric | 0.8718 |
| Dice metric | 0.8691 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+377 more
