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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
1-Palmitoyl-2-stearoyl-3-arachidonyl-glycerol
|
891.50
|
25.2
|
0
|
6
|
78.9
|
56
|
|
|
1-Palmitoyl-2-arachidonyl-3-arachidonyl-glycerol
|
919.50
|
26.3
|
0
|
6
|
78.9
|
58
|
|
|
1-Stearoyl-2-stearoyl-3-arachidonyl-glycerol
|
919.50
|
26.3
|
0
|
6
|
78.9
|
58
|
|
|
1-Stearoyl-2-arachidonyl-3-arachidonyl-glycerol
|
947.60
|
27.4
|
0
|
6
|
78.9
|
60
|
|
|
S-[2-[3-[[(2R)-4-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-hydroxybenzenecarbothioate
|
887.60
|
-4.3
|
10
|
23
|
438.59
|
21
|
|
|
Apigenin 6-C-glucoside 8-C-arabinoside
|
564.50
|
-1.6
|
10
|
14
|
250.97
|
5
|
|
|
Sesamolinol 4'-O-b-D-glucosyl (1->6)-O-b-D-glucoside
|
696.60
|
-1.2
|
7
|
17
|
233.91
|
10
|
|
|
asparagoside F
|
1035.20
|
-0.9
|
12
|
22
|
335.06
|
11
|
|
|
Nummularine A
|
647.80
|
4.8
|
4
|
7
|
138.1
|
11
|
|
|
Acuminoside
|
448.50
|
-0.5
|
6
|
10
|
158.3
|
10
|
|
|
Neryl rhamnosyl-glucoside
|
462.50
|
-0.3
|
6
|
10
|
158.3
|
9
|
|
|
Alkaloid RC
|
531.50
|
0.3
|
4
|
12
|
148.77
|
3
|
|
|
Solacauline
|
824.00
|
1.4
|
8
|
15
|
220.46
|
7
|
|
|
Chlorogenoquinone
|
352.29
|
-1.7
|
4
|
9
|
158.43
|
5
|
|
|
(S)-a-Amino-2,5-dihydro-5-oxo-4-isoxazolepropanoic acid N2-glucoside
|
334.28
|
-5
|
6
|
11
|
188.61
|
5
|
|
|
4-[(E)-2-[2-carboxy-6-hydroxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydroindol-1-yl]ethenyl]pyridine-2,6-dicarboxylic acid
|
548.50
|
-0.2
|
8
|
15
|
247.64
|
8
|
|
|
7-{[(2Z)-5-(3-hydroxy-2,2-dimethyl-6-methylidenecyclohexyl)-3-methylpent-2-en-1-yl]oxy}-2H-chromen-2-one
|
382.50
|
5.3
|
1
|
4
|
59.67
|
6
|
|
|
Formononetin 7-(6''-malonylglucoside)
|
516.40
|
0.7
|
4
|
12
|
182.19
|
9
|
|
|
3'-Methoxyfukiic acid
|
286.23
|
-0.5
|
5
|
8
|
144.52
|
6
|
|
|
6''-Malonylgenistin
|
518.40
|
0.6
|
6
|
13
|
213.42
|
8
|
|
|
3-O-Methylcoumestrol
|
282.25
|
3.1
|
1
|
5
|
72.81
|
1
|
|
|
Asparagusic acid syn-S-oxide
|
166.20
|
-0.8
|
1
|
5
|
98.88
|
1
|
|
|
5alpha-Ethoxy-6beta-hydroxy-5,6-dihydrophysalin B
|
572.60
|
0.1
|
2
|
11
|
154.89
|
2
|
|
|
2'',6''-Digalloyliriflophenone 3-C-glucoside
|
712.60
|
1.7
|
12
|
18
|
321.66
|
10
|
|
|
2'',3'',6''-Trigalloyliriflophenone 3-C-glucoside
|
864.70
|
2.9
|
14
|
22
|
388.42
|
13
|
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