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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-4-methoxyquinoline
|
305.30
|
4.3
|
0
|
4
|
40.58
|
3
|
|
|
Flemistrictin F
|
324.40
|
3.3
|
2
|
4
|
66.76
|
3
|
|
|
5-Methoxyisolariciresinol
|
390.40
|
2
|
4
|
7
|
108.61
|
6
|
|
|
(6S,7S,8R)-8-(4-hydroxy-3-methoxyphenyl)-6,7-bis(hydroxymethyl)-1,3-dimethoxy-5,6,7,8-tetrahydronaphthalen-2-ol
|
390.40
|
2
|
4
|
7
|
108.61
|
6
|
|
|
4-[(2R,3R)-4-(1,3-benzodioxol-5-yl)-2,3-dimethylbutyl]benzene-1,2-diol
|
314.40
|
4.8
|
2
|
4
|
58.92
|
5
|
|
|
9Z,11E,13-Tetradecatrienal
|
206.32
|
4.6
|
0
|
1
|
17.07
|
10
|
|
|
N-[(4E,8Z)-1,3-dihydroxyoctadeca-4,8-dien-2-yl]hexadecanamide 1-glucoside
|
698.00
|
10.3
|
6
|
8
|
148.71
|
32
|
|
|
11-[3-[3,4-Dihydroxy-5-[3-hydroxy-6-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexadecanoic acid
|
1035.10
|
-1.3
|
14
|
25
|
392.59
|
26
|
|
|
Caesalpiniaphenol F
|
332.30
|
1.8
|
3
|
6
|
88.38
|
4
|
|
|
Hexadecyl (E)-ferulate
|
418.60
|
9.6
|
1
|
4
|
55.76
|
19
|
|
|
3,4-Dihydroxypipecolic acid
|
161.16
|
-3.8
|
4
|
5
|
89.79
|
1
|
|
|
Myricetin 3-arabinofuranoside
|
450.30
|
0.6
|
8
|
12
|
210.51
|
4
|
|
|
3-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
|
450.30
|
0.6
|
8
|
12
|
210.51
|
4
|
|
|
Myricetin 3-alpha-L-arabinofuranoside
|
450.30
|
0.6
|
8
|
12
|
210.51
|
4
|
|
|
5,7-Dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
508.40
|
0.7
|
7
|
13
|
208.74
|
6
|
|
|
Neosakuranin
|
448.40
|
1.1
|
6
|
10
|
166.14
|
7
|
|
|
(E)-1-[2-hydroxy-4-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one
|
448.40
|
1.1
|
6
|
10
|
166.14
|
7
|
|
|
1-(4-Hydroxy-3-methoxyphenyl)propane-1,2-diol
|
198.22
|
-0.2
|
3
|
4
|
69.92
|
3
|
|
|
1,2,3,4,8-pentahydroxy-6-methoxy-3-methyl-5-(4,5,6,7,8-pentahydroxy-2-methoxy-7-methyl-9,10-dioxo-6,8-dihydro-5H-anthracen-1-yl)-2,4-dihydro-1H-anthracene-9,10-dione
|
670.60
|
-3
|
10
|
16
|
289.04
|
3
|
|
|
7-Hydroxy-4-methoxy-2,3-methylenedioxyphenanthrene
|
268.26
|
3.9
|
1
|
4
|
47.92
|
1
|
|
|
7,12,16-Trimethyl-15-(6-methylhept-5-en-2-yl)pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol
|
412.70
|
9.4
|
1
|
1
|
20.23
|
4
|
|
|
31-Norcycloartenol
|
412.70
|
9.4
|
1
|
1
|
20.23
|
4
|
|
|
(2S,3R,4S,5S,6R)-2-[[(2R,3R)-3,5-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
436.40
|
0
|
7
|
10
|
169.3
|
4
|
|
|
alpha-Caryophylladienol
|
220.35
|
3.3
|
1
|
1
|
20.23
|
0
|
|
|
Caryophylla-4,8-dien-5-ol
|
220.35
|
3.3
|
1
|
1
|
20.23
|
0
|
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