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DocumentationIdentifier: MM303510
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM303510 |
| SMILES |
C=COC(C=C)CNC=O
|
| InChIKey |
BICOBUBDGXCCCT-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
0.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM303634
Similarity: 0.7297
Similarity to MM303634
| Tanimoto metric | 0.7297 |
|---|---|
| Cosine metric | 0.8542 |
| Dice metric | 0.8438 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM388164
Similarity: 0.6718
Similarity to MM388164
| Tanimoto metric | 0.6718 |
|---|---|
| Cosine metric | 0.8037 |
| Dice metric | 0.8037 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM388707
Similarity: 0.6403
Similarity to MM388707
| Tanimoto metric | 0.6403 |
|---|---|
| Cosine metric | 0.781 |
| Dice metric | 0.7807 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+248 more
