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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(Z)-Akuammidine
|
352.40
|
1.5
|
2
|
4
|
65.56
|
3
|
|
|
16-Epivoacarpine
|
368.40
|
0.7
|
3
|
5
|
85.79
|
3
|
|
|
cyclohexyl 3-(1H-indol-3-yl)propanoate
|
271.35
|
3.9
|
1
|
2
|
42.09
|
5
|
|
|
(1R)-1-[[3-[5-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxyphenoxy]phenyl]methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinoline
|
638.80
|
7
|
0
|
8
|
61.86
|
11
|
|
|
2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-3-en-1-yl]-5-propylbenzene-1,3-diol
|
286.40
|
5.2
|
2
|
2
|
40.46
|
4
|
|
|
1-Hydroxy-6-methoxy-3-methylanthracene-9,10-dione
|
268.26
|
3.4
|
1
|
4
|
63.6
|
1
|
|
|
1,4-Diethyl-2-methylbenzene
|
148.24
|
3.9
|
0
|
0
|
0
|
2
|
|
|
3-Methylbenzaldehyde dimethyl acetal
|
166.22
|
1.9
|
0
|
2
|
18.46
|
3
|
|
|
2',4',alpha-Trihydroxy-4-methoxydihydrochalcone
|
288.29
|
2.8
|
3
|
5
|
86.99
|
5
|
|
|
2',4',7-Trihydroxyisoflavanone
|
272.25
|
2
|
3
|
5
|
86.99
|
1
|
|
|
rel-(2R,3S)-2-(Benzoyloxy)-3-hydroxybutanedioic acid
|
254.19
|
0.3
|
3
|
7
|
121.13
|
6
|
|
|
1,10-Undecadiene
|
152.28
|
5.7
|
0
|
0
|
0
|
8
|
|
|
[2-[3,5-Dihydroxy-2-[[2-hydroxy-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-yl]oxy]-6-methyloxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] acetate
|
823.00
|
3.1
|
7
|
14
|
214.06
|
8
|
|
|
[2-[3,5-Dihydroxy-2-[[2-hydroxy-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-yl]oxy]-6-methyloxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] acetate
|
823.00
|
3.1
|
7
|
14
|
214.06
|
8
|
|
|
1-Hexen-3-yne
|
80.13
|
2.3
|
0
|
0
|
0
|
0
|
|
|
(2-phenylacetyl)-L-aspartic acid
|
251.23
|
0.3
|
3
|
5
|
103.7
|
6
|
|
|
Botryorhodine G
|
332.30
|
2.6
|
4
|
7
|
116.45
|
1
|
|
|
Boydone A
|
309.40
|
3
|
2
|
5
|
75.63
|
7
|
|
|
Rubasperone A
|
556.50
|
6
|
3
|
10
|
148.8
|
4
|
|
|
5-hydroxy-7-methoxy-4'-O-(3-methylbut-2-enyl) isoflavone
|
352.40
|
4.8
|
1
|
5
|
68.9
|
5
|
|
|
Guignardone I
|
310.40
|
0.7
|
2
|
5
|
75.99
|
2
|
|
|
Furanone A
|
196.20
|
1.2
|
1
|
4
|
63.6
|
4
|
|
|
Mitibetaimol A
|
234.33
|
2.8
|
1
|
2
|
37.3
|
0
|
|
|
Similin B
|
265.35
|
3
|
1
|
4
|
69.39
|
4
|
|
|
Cinnamomin
|
2358.60
|
-12.9
|
38
|
40
|
1073.89
|
77
|
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