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DocumentationIdentifier: MM278957
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM278957 |
| SMILES |
C#CCC(=C)COC=CF
|
| InChIKey |
HLQWIXOPEBXMHH-UHFFFAOYSA-N
|
| MW [Da] |
140.16
Automatically obtained from RDkit software. |
| LogP |
2.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM167424
Similarity: 0.7917
Similarity to MM167424
| Tanimoto metric | 0.7917 |
|---|---|
| Cosine metric | 0.8898 |
| Dice metric | 0.8837 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM376641
Similarity: 0.6967
Similarity to MM376641
| Tanimoto metric | 0.6967 |
|---|---|
| Cosine metric | 0.8234 |
| Dice metric | 0.8213 |
| MW: | 140.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM303437
Similarity: 0.6726
Similarity to MM303437
| Tanimoto metric | 0.6726 |
|---|---|
| Cosine metric | 0.8043 |
| Dice metric | 0.8042 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+459 more
