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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Epioritin-4beta-ol
|
290.27
|
0.7
|
5
|
6
|
110.38
|
1
|
|
|
Thujol
|
154.25
|
2.6
|
1
|
1
|
20.23
|
1
|
|
|
Neo-3-Thujol
|
154.25
|
2.6
|
1
|
1
|
20.23
|
1
|
|
|
(1S,3R,4R,5R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-ol
|
154.25
|
2.6
|
1
|
1
|
20.23
|
1
|
|
|
(+)-Thujan-3-ol
|
154.25
|
2.6
|
1
|
1
|
20.23
|
1
|
|
|
Thujyl alcohol
|
154.25
|
2.6
|
1
|
1
|
20.23
|
1
|
|
|
(+)-alpha-Thujone
|
152.23
|
2.3
|
0
|
1
|
17.07
|
1
|
|
|
alpha-Thujone
|
152.23
|
2.3
|
0
|
1
|
17.07
|
1
|
|
|
(2R,4aS,5S,6aR,6aS,6bR,8aR,10S,12aR,14bS)-5,10-dihydroxy-4a-(hydroxymethyl)-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid
|
488.70
|
5.3
|
4
|
5
|
97.99
|
2
|
|
|
Jamaicin
|
378.40
|
3.9
|
0
|
6
|
67.13
|
2
|
|
|
Jasmolin I
|
330.50
|
5.4
|
0
|
3
|
43.37
|
7
|
|
|
[(1S)-2-methyl-4-oxo-3-[(E)-pent-2-enyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
|
330.50
|
5.4
|
0
|
3
|
43.37
|
7
|
|
|
Jasmolin II
|
374.50
|
4.5
|
0
|
5
|
69.67
|
9
|
|
|
[(1S)-2-methyl-4-oxo-3-[(E)-pent-2-enyl]cyclopent-2-en-1-yl] (1R,3R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate
|
374.50
|
4.5
|
0
|
5
|
69.67
|
9
|
|
|
(Z,S)-jasmololone
|
180.24
|
1.1
|
1
|
2
|
37.3
|
3
|
|
|
Luteolin 4'-glucoside
|
448.40
|
0.5
|
7
|
11
|
190.28
|
4
|
|
|
Luteolin-4'-glucoside
|
448.40
|
0.5
|
7
|
11
|
190.28
|
4
|
|
|
5-Prop-1-ynylthiophene-2-carboxylic acid
|
166.20
|
2.3
|
1
|
3
|
65.54
|
2
|
|
|
(1S,2R,7S,8S,9S)-2,6,6,9-Tetramethyltricyclo[5.4.0.02,9]undecan-8-ol
|
222.37
|
4.5
|
1
|
1
|
20.23
|
0
|
|
|
Jurubidine
|
415.70
|
6.2
|
1
|
3
|
44.48
|
0
|
|
|
Jurubin
|
595.80
|
3.6
|
6
|
9
|
154.86
|
7
|
|
|
Juzunol
|
300.26
|
2.3
|
3
|
6
|
104.06
|
2
|
|
|
(1S,4S,9S,10R,13S)-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane
|
272.50
|
6.9
|
0
|
0
|
0
|
0
|
|
|
(4R,9R,10S)-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane
|
272.50
|
6.9
|
0
|
0
|
0
|
0
|
|
|
(1R,4S,9S,10R,13S)-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane
|
272.50
|
6.9
|
0
|
0
|
0
|
0
|
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