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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Thalbaicalidine
|
371.40
|
3
|
1
|
6
|
60.39
|
4
|
|
|
6-((Z)-pentadec-8-en-1-yl)salicylic acid
|
374.60
|
9.6
|
2
|
3
|
57.53
|
16
|
|
|
[(3aR,4R,6R,6aR,7R,9aS,9bS)-7,9a-dihydroxy-9-methyl-3-methylidene-2-oxospiro[3a,4,5,6a,7,9b-hexahydroazuleno[4,5-b]furan-6,2'-oxirane]-4-yl] (E)-2-methylbut-2-enoate
|
376.40
|
0.3
|
2
|
7
|
105.59
|
3
|
|
|
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(2R)-4-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethylcyclohexyl]butan-2-yl]oxyoxane-3,4,5-triol
|
376.50
|
1.2
|
5
|
7
|
119.61
|
6
|
|
|
3,7-Dimethylocta-1,5,7-trien-3-ol
|
152.23
|
2.8
|
1
|
1
|
20.23
|
4
|
|
|
8,5'-Diferulic acid
|
386.40
|
2.7
|
4
|
8
|
133.52
|
7
|
|
|
(E)-4-[(1S,4S,6R)-2,2,6-trimethyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7-oxabicyclo[4.1.0]heptan-1-yl]but-3-en-2-one
|
386.40
|
-0.6
|
4
|
8
|
128.98
|
5
|
|
|
Piperbetol
|
386.40
|
3.5
|
1
|
6
|
82.06
|
7
|
|
|
Euglobal IIb
|
386.50
|
5.7
|
2
|
5
|
83.83
|
5
|
|
|
(8aR,10aS)-1,3-dihydroxy-7-methyl-2-(3-methylbutanoyl)-10a-propan-2-yl-5,8,8a,9-tetrahydroxanthene-4-carbaldehyde
|
386.50
|
5.3
|
2
|
5
|
83.83
|
5
|
|
|
(8aR,10aR)-1,3-dihydroxy-8a-methyl-4-(3-methylbutanoyl)-6-propan-2-yl-7,8,9,10a-tetrahydroxanthene-2-carbaldehyde
|
386.50
|
5.1
|
2
|
5
|
83.83
|
5
|
|
|
Tetradecyl (E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate
|
390.60
|
8.5
|
1
|
4
|
55.76
|
17
|
|
|
1,3,5-Trihydroxy-2,8-bis(3-methylbut-2-enyl)-10-methyl-9-acridone
|
393.50
|
6.5
|
3
|
5
|
82.69
|
4
|
|
|
8,10,12-Trihydroxy-3-methoxy-1-methyl-6,11-dioxotetracene-2-carboxylic acid
|
394.30
|
3.5
|
4
|
8
|
141.36
|
2
|
|
|
4-Methyl-2-propylpentan-1-ol
|
144.25
|
2.9
|
1
|
1
|
20.23
|
5
|
|
|
Cowaxanthone
|
410.50
|
6.2
|
3
|
6
|
100.13
|
6
|
|
|
(2,4,10,15-Tetrahydroxy-5,5,10,15-tetramethyl-7-oxapentacyclo[12.2.1.01,11.04,9.06,8]heptadecan-3-yl) acetate
|
410.50
|
0.3
|
4
|
7
|
119.75
|
2
|
|
|
Heptacosane-6,8-diol
|
412.70
|
11.6
|
2
|
2
|
40.46
|
24
|
|
|
(6R,8S)-heptacosane-6,8-diol
|
412.70
|
11.6
|
2
|
2
|
40.46
|
24
|
|
|
(1R,2R,6R,9S,10R,11R,14S,15S,17R,18S,20S,23R,24S)-6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosane-17,20-diol
|
415.70
|
5.5
|
2
|
3
|
43.7
|
0
|
|
|
nymphaeol B
|
424.50
|
5.8
|
4
|
6
|
107.22
|
6
|
|
|
(3S,4aR,6aR,6aS,6bR,8aR,12aR,14bS)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13-tetradecahydropicen-3-ol
|
426.70
|
9.2
|
1
|
1
|
20.23
|
0
|
|
|
[(2R,3S)-6-oxo-2-[(1S,2R,3S)-1,2,3-triacetyloxyheptyl]-2,3-dihydropyran-3-yl] acetate
|
428.40
|
1.9
|
0
|
10
|
131.5
|
14
|
|
|
(1R,2S,6S,9S,10S,11R,14S,15S,18S,20S,23R)-10,20-dihydroxy-6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosan-17-one
|
429.60
|
3.9
|
2
|
4
|
60.77
|
0
|
|
|
1,7-Bis(4-hydroxy-3-methoxyphenyl)-5-oxoheptane-3-sulfonic acid
|
438.50
|
2.3
|
3
|
8
|
138.74
|
11
|
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