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DocumentationIdentifier: MM388192
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM388192 |
| SMILES |
N=CN(CC=CF)CCN
|
| InChIKey |
RGMYRGKKTFTTJF-UHFFFAOYSA-N
|
| MW [Da] |
145.18
Automatically obtained from RDkit software. |
| LogP |
0.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM303683
Similarity: 0.6306
Similarity to MM303683
| Tanimoto metric | 0.6306 |
|---|---|
| Cosine metric | 0.7735 |
| Dice metric | 0.7735 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM393884
Similarity: 0.6195
Similarity to MM393884
| Tanimoto metric | 0.6195 |
|---|---|
| Cosine metric | 0.765 |
| Dice metric | 0.765 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM394045
Similarity: 0.6087
Similarity to MM394045
| Tanimoto metric | 0.6087 |
|---|---|
| Cosine metric | 0.7569 |
| Dice metric | 0.7568 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+231 more
