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DocumentationIdentifier: MM304753
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM304753 |
| SMILES |
CNC(=O)CCN1CC1
|
| InChIKey |
NIFXANCMFDIIGX-UHFFFAOYSA-N
|
| MW [Da] |
128.18
Automatically obtained from RDkit software. |
| LogP |
-0.56
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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MM303559
Similarity: 0.9255
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| Tanimoto metric | 0.9255 |
|---|---|
| Cosine metric | 0.962 |
| Dice metric | 0.9613 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM419193
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| Tanimoto metric | 0.9255 |
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| Cosine metric | 0.962 |
| Dice metric | 0.9613 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM316969
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| Tanimoto metric | 0.8 |
|---|---|
| Cosine metric | 0.889 |
| Dice metric | 0.8889 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+337 more
