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DocumentationIdentifier: MM291452
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291452 |
| SMILES |
CC(COCCN)NC=O
|
| InChIKey |
HQFUTIOQGGJTMM-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
-0.9
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM303066
Similarity: 0.7629
Similarity to MM303066
| Tanimoto metric | 0.7629 |
|---|---|
| Cosine metric | 0.8667 |
| Dice metric | 0.8655 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM69386
Similarity: 0.7551
Similarity to MM69386
| Tanimoto metric | 0.7551 |
|---|---|
| Cosine metric | 0.8619 |
| Dice metric | 0.8605 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363068
Similarity: 0.7349
Similarity to MM363068
| Tanimoto metric | 0.7349 |
|---|---|
| Cosine metric | 0.8539 |
| Dice metric | 0.8472 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+368 more
