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DocumentationIdentifier: MM303434
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM303434 |
| SMILES |
CNCC(COC)NC=N
|
| InChIKey |
NAHVIWIRKXUQFS-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-0.58
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM177829
Similarity: 0.757
Similarity to MM177829
| Tanimoto metric | 0.757 |
|---|---|
| Cosine metric | 0.8701 |
| Dice metric | 0.8617 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM386439
Similarity: 0.6923
Similarity to MM386439
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8209 |
| Dice metric | 0.8182 |
| MW: | 144.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM386278
Similarity: 0.688
Similarity to MM386278
| Tanimoto metric | 0.688 |
|---|---|
| Cosine metric | 0.8152 |
| Dice metric | 0.8152 |
| MW: | 145.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+169 more
