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DocumentationIdentifier: MM293255
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293255 |
| SMILES |
C=COC(C)(C)CNC=O
|
| InChIKey |
JWFCRIYUNKOZMS-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.67
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM303634
Similarity: 0.7642
Similarity to MM303634
| Tanimoto metric | 0.7642 |
|---|---|
| Cosine metric | 0.8742 |
| Dice metric | 0.8663 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM58075
Similarity: 0.6204
Similarity to MM58075
| Tanimoto metric | 0.6204 |
|---|---|
| Cosine metric | 0.7665 |
| Dice metric | 0.7658 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM226253
Similarity: 0.6176
Similarity to MM226253
| Tanimoto metric | 0.6176 |
|---|---|
| Cosine metric | 0.7641 |
| Dice metric | 0.7636 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+166 more
