Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM303899
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM303899 |
| SMILES |
C=CCC=CC(C)NC=O
|
| InChIKey |
QHCSIACBLFZGQM-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
MM284328
Similarity: 0.7368
Similarity to MM284328
| Tanimoto metric | 0.7368 |
|---|---|
| Cosine metric | 0.8486 |
| Dice metric | 0.8485 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM281640
Similarity: 0.7245
Similarity to MM281640
| Tanimoto metric | 0.7245 |
|---|---|
| Cosine metric | 0.841 |
| Dice metric | 0.8402 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM302861
Similarity: 0.716
Similarity to MM302861
| Tanimoto metric | 0.716 |
|---|---|
| Cosine metric | 0.8462 |
| Dice metric | 0.8345 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+257 more
