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DocumentationIdentifier: MM350389
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM350389 |
| SMILES |
C=C(CNC=N)C(O)CC
|
| InChIKey |
BTRYYHUXIRHIBN-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.51
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162490
Similarity: 0.8065
Similarity to MM162490
| Tanimoto metric | 0.8065 |
|---|---|
| Cosine metric | 0.898 |
| Dice metric | 0.8929 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM303423
Similarity: 0.7143
Similarity to MM303423
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8338 |
| Dice metric | 0.8333 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292789
Similarity: 0.6966
Similarity to MM292789
| Tanimoto metric | 0.6966 |
|---|---|
| Cosine metric | 0.8212 |
| Dice metric | 0.8211 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+266 more
