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DocumentationIdentifier: MM303967
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM303967 |
| SMILES |
CC(C)N(C)CC=CCN
|
| InChIKey |
PSPNUFBXAVWDDP-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.84
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162838
Similarity: 0.8923
Similarity to MM162838
| Tanimoto metric | 0.8923 |
|---|---|
| Cosine metric | 0.9446 |
| Dice metric | 0.9431 |
| MW: | 127.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM303965
Similarity: 0.7532
Similarity to MM303965
| Tanimoto metric | 0.7532 |
|---|---|
| Cosine metric | 0.8598 |
| Dice metric | 0.8593 |
| MW: | 141.26 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM372429
Similarity: 0.7313
Similarity to MM372429
| Tanimoto metric | 0.7313 |
|---|---|
| Cosine metric | 0.851 |
| Dice metric | 0.8448 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+480 more
