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DocumentationIdentifier: MM388707
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM388707 |
| SMILES |
COC(C=CF)CNC=O
|
| InChIKey |
HBUZKONSQUWPOA-UHFFFAOYSA-N
|
| MW [Da] |
147.15
Automatically obtained from RDkit software. |
| LogP |
0.23
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM157181
Similarity: 0.735
Similarity to MM157181
| Tanimoto metric | 0.735 |
|---|---|
| Cosine metric | 0.8573 |
| Dice metric | 0.8473 |
| MW: | 133.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM303510
Similarity: 0.6403
Similarity to MM303510
| Tanimoto metric | 0.6403 |
|---|---|
| Cosine metric | 0.781 |
| Dice metric | 0.7807 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM24717
Similarity: 0.6081
Similarity to MM24717
| Tanimoto metric | 0.6081 |
|---|---|
| Cosine metric | 0.7564 |
| Dice metric | 0.7563 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+124 more
