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DocumentationIdentifier: MM405874
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM405874 |
| SMILES |
CCN(CC)CC=CCO
|
| InChIKey |
YMJFIHWYTLHXSB-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
0.88
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM168132
Similarity: 0.9508
Similarity to MM168132
| Tanimoto metric | 0.9508 |
|---|---|
| Cosine metric | 0.9751 |
| Dice metric | 0.9748 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM199486
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| Tanimoto metric | 0.7541 |
|---|---|
| Cosine metric | 0.8684 |
| Dice metric | 0.8598 |
| MW: | 127.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM303969
Similarity: 0.7532
Similarity to MM303969
| Tanimoto metric | 0.7532 |
|---|---|
| Cosine metric | 0.8633 |
| Dice metric | 0.8593 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+394 more
