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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
2-[7-Methoxy-3-(2-methylbut-3-en-2-yl)-2-oxochromen-6-yl]acetaldehyde
|
286.32
|
3.2
|
0
|
4
|
56.51
|
5
|
|
|
anisocoumarin B
|
246.26
|
3
|
1
|
4
|
59.67
|
3
|
|
|
2-(2-Hydroxypropan-2-yl)-6-[2-(oxiran-2-yl)propan-2-yl]-2,3-dihydrofuro[3,2-g]chromen-7-one
|
330.40
|
2.8
|
1
|
5
|
72.2
|
3
|
|
|
6-(3,4-Dihydroxy-2-methylbutan-2-yl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-7-one
|
348.40
|
1.8
|
3
|
6
|
100.13
|
4
|
|
|
6-(2,3-Dihydroxy-3-methylbutyl)-7-methoxy-3-(2-methylbut-3-en-2-yl)chromen-2-one
|
346.40
|
3.4
|
2
|
5
|
79.9
|
6
|
|
|
gerontoxanthone B
|
394.40
|
5.3
|
3
|
6
|
100.13
|
2
|
|
|
Artobilichromene
|
436.50
|
5.2
|
4
|
7
|
120.36
|
3
|
|
|
(3S,4S,5S,9R,10S,13R,17R)-4,10,13-trimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-2,3,4,5,6,7,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
412.70
|
8.5
|
1
|
1
|
20.23
|
5
|
|
|
2-Hydroxy-1-methoxy-7-methylanthracene-9,10-dione
|
268.26
|
2.8
|
1
|
4
|
63.6
|
1
|
|
|
Quercetin 3,5,3',4'-tetramethyl ether
|
358.30
|
2.9
|
1
|
7
|
87.36
|
5
|
|
|
Undeca-2z-ene-8,10-diynoic isobutylamide
|
231.33
|
3.6
|
1
|
1
|
29.1
|
8
|
|
|
(2E)-N-(2-Methylbutyl)-2-undecene-8,10-diynamide
|
245.36
|
4
|
1
|
1
|
29.1
|
9
|
|
|
(E)-N-(2-methylbutyl)dodec-2-en-8,10-diynamide
|
259.40
|
4.5
|
1
|
1
|
29.1
|
9
|
|
|
(2E,9Z)-N-(2-methylpropyl)pentadeca-2,9-dien-12,14-diynamide
|
285.40
|
5.1
|
1
|
1
|
29.1
|
11
|
|
|
(2E,9Z)-N-(2-methylpropyl)hexadeca-2,9-dien-12,14-diynamide
|
299.40
|
5.6
|
1
|
1
|
29.1
|
11
|
|
|
13-Hydroperoxyoctadeca-9,11-dienoic acid
|
312.40
|
5.4
|
2
|
4
|
66.76
|
15
|
|
|
1-Tetradecene
|
196.37
|
7.9
|
0
|
0
|
0
|
11
|
|
|
6-Tridecyne
|
180.33
|
6.1
|
0
|
0
|
0
|
7
|
|
|
1,3-Dibromopentane
|
229.94
|
3.1
|
0
|
0
|
0
|
3
|
|
|
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[5-(hydroxymethyl)-4-(methoxymethyl)-2-methylpyridin-3-yl]oxyoxane-3,4,5-triol
|
345.34
|
-2.1
|
5
|
9
|
141.73
|
6
|
|
|
3,4,5-Trihydroxybenzyl methyl ether
|
170.16
|
0.5
|
3
|
4
|
69.92
|
2
|
|
|
2-Methylsulfonylmethyl-3,4,5-trihydroxybenzyl methyl ether
|
262.28
|
-0.3
|
3
|
6
|
112.44
|
4
|
|
|
14-Hydroxycodeine
|
315.40
|
0.1
|
2
|
5
|
62.16
|
1
|
|
|
[(1R,2R,4S,5R,9R,10R,13R,14S,15S,17R)-9-(furan-3-yl)-15-[(1R)-1-hydroxy-2-methoxy-2-oxoethyl]-10,14,16,16-tetramethyl-7,18-dioxo-3,8-dioxapentacyclo[12.3.1.02,4.04,13.05,10]octadecan-17-yl] propanoate
|
558.60
|
2.4
|
1
|
10
|
141.87
|
7
|
|
|
3-O-Acetylswietenolide
|
528.60
|
2.3
|
1
|
9
|
129.34
|
6
|
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