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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Isowertin 2''-rhamnoside
|
592.50
|
-0.6
|
8
|
14
|
228.97
|
6
|
|
|
Isovitexin2''-O-arabinoside
|
564.50
|
-1.3
|
9
|
14
|
239.97
|
5
|
|
|
1-[2,4-dimethoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]ethanone
|
358.34
|
-0.9
|
4
|
9
|
134.91
|
6
|
|
|
1-[2,6-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]ethanone
|
358.34
|
-0.9
|
4
|
9
|
134.91
|
6
|
|
|
12a-Hydroxymunduserone
|
358.30
|
2
|
1
|
7
|
83.45
|
3
|
|
|
6-Hydroxysumatrol
|
426.40
|
3.8
|
2
|
8
|
103.68
|
3
|
|
|
Villinol
|
438.40
|
4.2
|
1
|
8
|
96.59
|
4
|
|
|
4-[2-[(2S,6R)-6-(4-hydroxyphenyl)oxan-2-yl]ethyl]phenol
|
298.40
|
4.1
|
2
|
3
|
49.69
|
4
|
|
|
7,2'-Dihydroxy-8,4'-dimethoxyisoflav-3-ene
|
300.30
|
2.7
|
2
|
5
|
68.15
|
3
|
|
|
(2E,4E,6E)-1-(3,4-dihydro-2H-pyridin-1-yl)deca-2,4,6-trien-1-one
|
231.33
|
3.6
|
0
|
1
|
20.31
|
5
|
|
|
Pyridine, 1,2,3,4-tetrahydro-1-(1-oxo-2,4,6-decatrienyl)-, (E,E,Z)-
|
231.33
|
3.6
|
0
|
1
|
20.31
|
5
|
|
|
(2E,4E)-N-[2-(4-methoxyphenyl)ethyl]deca-2,4-dienamide
|
301.40
|
5
|
1
|
2
|
38.33
|
10
|
|
|
(2E,4E)-1-(3,4-dihydro-2H-pyridin-1-yl)deca-2,4-dien-1-one
|
233.35
|
4.1
|
0
|
1
|
20.31
|
6
|
|
|
(2E,4E,8Z)-1-(3,4-dihydro-2H-pyridin-1-yl)deca-2,4,8-trien-1-one
|
231.33
|
3.2
|
0
|
1
|
20.31
|
5
|
|
|
(2E,4E,6E,8E)-1-(3,4-dihydro-2H-pyridin-1-yl)deca-2,4,6,8-tetraen-1-one
|
229.32
|
3.3
|
0
|
1
|
20.31
|
4
|
|
|
(2E,4E,8Z)-N-Isobutyldeca-2,4,8-trienamide
|
221.34
|
3.6
|
1
|
1
|
29.1
|
7
|
|
|
(2E,4E)-N-[2-(4-hydroxyphenyl)ethyl]deca-2,4-dienamide
|
287.40
|
4.7
|
2
|
2
|
49.33
|
9
|
|
|
(2E,4E)-1-(3,4-dihydro-2H-pyridin-1-yl)undeca-2,4-dien-8,10-diyn-1-one
|
239.31
|
2.9
|
0
|
1
|
20.31
|
5
|
|
|
(2E,4E,12E)-N-(2-methylpropyl)tetradeca-2,4,12-trien-8,10-diynamide
|
269.40
|
4.4
|
1
|
1
|
29.1
|
7
|
|
|
Noricaritin
|
372.40
|
3.1
|
5
|
7
|
131.36
|
4
|
|
|
5-Hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one
|
638.60
|
-0.8
|
8
|
16
|
247.43
|
8
|
|
|
8-[4,5-Dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
|
594.50
|
-1.4
|
10
|
15
|
260.2
|
6
|
|
|
2-(3,4-Dihydroxyphenyl)-8-(2-O-beta-L-galactopyranosyl-beta-D-glucopyranosyl)-5,7-dihydroxy-4H-1-Benzopyran-4-one
|
610.50
|
-1.7
|
11
|
16
|
280.43
|
6
|
|
|
7-Methoxy-6-(1-methoxyethyl)-2,2-dimethyl-2H-1-benzopyran
|
248.32
|
2.9
|
0
|
3
|
27.69
|
3
|
|
|
6-(1-Ethoxyethyl)-7-methoxy-2,2-dimethyl-2H-1-benzopyran
|
262.34
|
3.2
|
0
|
3
|
27.69
|
4
|
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