Identifier: MM303192
2D Structure
3D Structure
Source:
General | |
Identifier | MM303192 |
SMILES |
COCC#CC=CC(=O)O
|
InChIKey |
JOFDSCHFKNZSCA-UHFFFAOYSA-N
|
MW [Da] |
140.14
Automatically obtained from RDkit software. |
LogP |
0.28
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
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Tanimoto metric | 0.8608 |
---|---|
Cosine metric | 0.9278 |
Dice metric | 0.9252 |
MW: | 126.11 |
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PI: | 3
Total passive interactions
|
LogP: | -0.38 |
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MM93436
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Tanimoto metric | 0.7684 |
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Cosine metric | 0.8706 |
Dice metric | 0.869 |
MW: | 140.14 |
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PI: | 1
Total passive interactions
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LogP: | -0.29 |
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Cosine metric | 0.8554 |
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MW: | 140.09 |
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PI: | 3
Total passive interactions
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LogP: | -0.28 |
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---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+261 more