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DocumentationIdentifier: MM303663
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM303663 |
| SMILES |
CC=CC(CCO)NC=O
|
| InChIKey |
SBTVJRUUAYVXJH-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM177982
Similarity: 0.7788
Similarity to MM177982
| Tanimoto metric | 0.7788 |
|---|---|
| Cosine metric | 0.8825 |
| Dice metric | 0.8756 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM284607
Similarity: 0.6071
Similarity to MM284607
| Tanimoto metric | 0.6071 |
|---|---|
| Cosine metric | 0.7556 |
| Dice metric | 0.7556 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM293744
Similarity: 0.585
Similarity to MM293744
| Tanimoto metric | 0.585 |
|---|---|
| Cosine metric | 0.7385 |
| Dice metric | 0.7382 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+147 more
