Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM303986
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM303986 |
| SMILES |
C=CCNC(=O)C(C)=CC
|
| InChIKey |
AJYOWDATSQMGOK-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
1.25
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM273798
Similarity: 0.7589
Similarity to MM273798
| Tanimoto metric | 0.7589 |
|---|---|
| Cosine metric | 0.8636 |
| Dice metric | 0.8629 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM54274
Similarity: 0.75
Similarity to MM54274
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8575 |
| Dice metric | 0.8571 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM296277
Similarity: 0.75
Similarity to MM296277
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8575 |
| Dice metric | 0.8571 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+472 more
