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DocumentationIdentifier: MM272035
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272035 |
| SMILES |
CN(C)CC(CO)NC=N
|
| InChIKey |
QFZPMOMAZCJXDS-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-0.89
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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MM177829
Similarity: 0.802
Similarity to MM177829
| Tanimoto metric | 0.802 |
|---|---|
| Cosine metric | 0.8955 |
| Dice metric | 0.8901 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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| Tanimoto metric | 0.7297 |
|---|---|
| Cosine metric | 0.8449 |
| Dice metric | 0.8438 |
| MW: | 144.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM303434
Similarity: 0.664
Similarity to MM303434
| Tanimoto metric | 0.664 |
|---|---|
| Cosine metric | 0.7984 |
| Dice metric | 0.7981 |
| MW: | 145.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+173 more
