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DocumentationIdentifier: MM284328
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM284328 |
| SMILES |
CC(C=CCC=O)NC=O
|
| InChIKey |
SFIFUEHIWHFOQA-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
0.27
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM303899
Similarity: 0.7368
Similarity to MM303899
| Tanimoto metric | 0.7368 |
|---|---|
| Cosine metric | 0.8486 |
| Dice metric | 0.8485 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM302861
Similarity: 0.6905
Similarity to MM302861
| Tanimoto metric | 0.6905 |
|---|---|
| Cosine metric | 0.8309 |
| Dice metric | 0.8169 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM281640
Similarity: 0.6863
Similarity to MM281640
| Tanimoto metric | 0.6863 |
|---|---|
| Cosine metric | 0.8142 |
| Dice metric | 0.814 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+258 more
