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DocumentationIdentifier: MM296277
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM296277 |
| SMILES |
CCNC(=O)C(C)=CCN
|
| InChIKey |
SIGKZNKGASCNJM-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.03
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM66508
Similarity: 0.7574
Similarity to MM66508
| Tanimoto metric | 0.7574 |
|---|---|
| Cosine metric | 0.8632 |
| Dice metric | 0.8619 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM303986
Similarity: 0.75
Similarity to MM303986
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8575 |
| Dice metric | 0.8571 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM54274
Similarity: 0.726
Similarity to MM54274
| Tanimoto metric | 0.726 |
|---|---|
| Cosine metric | 0.8413 |
| Dice metric | 0.8413 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+413 more
