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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
[(3aR,4S,9R,9aS,9bR)-9-formyl-6-methyl-3-methylidene-2,7-dioxo-4,5,8,9,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl] 2-(4-hydroxyphenyl)acetate
|
410.40
|
1.3
|
1
|
7
|
106.97
|
5
|
|
|
(1S,4S,8R,9R,12S,13S,14S,16S,17S)-9,14-dihydroxy-17-(methoxymethyl)-7,7-dimethyl-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione
|
394.50
|
0.9
|
2
|
7
|
102.29
|
2
|
|
|
[(1S,4S,6S,8R,9R,12S,13S,14S,16S,17S)-9,14-dihydroxy-17-(methoxymethyl)-7,7-dimethyl-2,18-dioxo-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecan-6-yl] acetate
|
452.50
|
0.5
|
2
|
9
|
128.59
|
4
|
|
|
2-Hexyl-5-heptylresorcinol
|
292.50
|
7.7
|
2
|
2
|
40.46
|
11
|
|
|
(1aS,1bS,3R,3aR,5S,7bR,9R,9aR)-5-[(1R)-1-bromo-2-hydroxyethyl]-1a-(hydroxymethyl)-5,7b-dimethyl-1,1b,2,3,3a,4,6,8,9,9a-decahydrocyclopropa[a]phenanthrene-3,9-diol
|
415.40
|
1.6
|
4
|
4
|
80.92
|
3
|
|
|
19-Carboxydigitoxigenin
|
418.50
|
1.6
|
3
|
6
|
104.06
|
3
|
|
|
trans-Dipropenyl disulfide
|
146.30
|
2.4
|
0
|
2
|
50.6
|
3
|
|
|
Stigmasta-5,25-dienol
|
412.70
|
9.4
|
1
|
1
|
20.23
|
7
|
|
|
Trimethyldihydrodithiazine
|
161.30
|
1.7
|
0
|
3
|
53.84
|
0
|
|
|
e-Farnesol
|
222.37
|
4.8
|
1
|
1
|
20.23
|
7
|
|
|
(2R,3S)-2-(3,4-dihydroxyphenyl)-8-[(2S,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
|
578.50
|
2.4
|
10
|
12
|
220.76
|
3
|
|
|
Schottenone
|
412.70
|
8.7
|
0
|
1
|
17.07
|
6
|
|
|
1,26-Hexacosanediol diferulate
|
751.00
|
15.7
|
2
|
8
|
111.52
|
35
|
|
|
1-(5,8-Dimethoxy-2,2-dimethylchromen-6-yl)-3-hydroxy-3-phenylprop-2-en-1-one
|
366.40
|
4.5
|
1
|
5
|
64.99
|
5
|
|
|
9,19-Cyclolanost-23-ene-3,25-diol
|
442.70
|
8
|
2
|
2
|
40.46
|
4
|
|
|
1-Bromo-3-iodoacetone
|
262.87
|
1.4
|
0
|
1
|
17.07
|
2
|
|
|
2-Dec-9-enylphenanthrene
|
316.50
|
9.4
|
0
|
0
|
0
|
9
|
|
|
Epoxy-z-coniferyl alcohol
|
194.18
|
1.1
|
2
|
4
|
62.22
|
2
|
|
|
N-methyl-N-(2-methylpropyl)-2,4-tetradecadiene-8,10-diynamide
|
285.40
|
4.9
|
0
|
1
|
20.31
|
8
|
|
|
2,3-Anhydromannose
|
162.14
|
-2.4
|
3
|
5
|
90.29
|
4
|
|
|
3-Hydroxy-4,5-methylenedioxybibenzyl
|
242.27
|
3.6
|
1
|
3
|
38.69
|
3
|
|
|
8-Geranyl-5,7-dihydroxychromone
|
314.40
|
5.2
|
2
|
4
|
70.67
|
5
|
|
|
4-Hydroxy-2-methoxydihydrochalcone
|
256.30
|
2.6
|
1
|
3
|
46.53
|
4
|
|
|
2',7-Dihydroxy-4',6-dimethoxyisoflavan
|
302.32
|
2.9
|
2
|
5
|
68.15
|
3
|
|
|
8-Geranyl-4-(3,3-dimethylallyl)-7-methoxy-1,3,6-trihydroxyxanthone
|
478.60
|
8.1
|
3
|
6
|
100.13
|
8
|
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