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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
2-(3-Oxoprop-1-en-1-yl)phenyl benzoate
|
252.26
|
3.2
|
0
|
3
|
43.37
|
5
|
|
|
2,6,4'-Trihydroxy-4-methoxybenzophenone
|
260.24
|
2.7
|
3
|
5
|
86.99
|
3
|
|
|
(3S,10S)-panaxydiol
|
260.40
|
4.3
|
2
|
2
|
40.46
|
9
|
|
|
Pentacosanoic acid
|
382.70
|
11.2
|
1
|
2
|
37.3
|
23
|
|
|
Nardoperoxide
|
266.33
|
1
|
1
|
4
|
55.76
|
1
|
|
|
(E)-3-(2,6-dihydroxy-4-methoxyphenyl)-1-phenylprop-2-en-1-one
|
270.28
|
3
|
2
|
4
|
66.76
|
4
|
|
|
Pummeline
|
271.27
|
2.9
|
2
|
5
|
71.69
|
1
|
|
|
8,10,12-Octadecatriynoic acid
|
272.40
|
5.9
|
1
|
2
|
37.3
|
11
|
|
|
Perilloxin
|
274.31
|
2.5
|
1
|
4
|
47.92
|
2
|
|
|
6-(3-Heptyloxiran-2-yl)-1-(oxiran-2-yl)hexa-2,4-diyn-1-one
|
274.35
|
4.1
|
0
|
3
|
42.13
|
9
|
|
|
Hexacosanoic acid
|
396.70
|
11.8
|
1
|
2
|
37.3
|
24
|
|
|
1,3-Dihydroxy-8-methoxy-6-methylanthracene-9,10-dione
|
284.26
|
3
|
2
|
5
|
83.83
|
1
|
|
|
Methyl 3-(4-formylphenoxy)-4-methoxybenzoate
|
286.28
|
3
|
0
|
5
|
61.83
|
6
|
|
|
Syn-copalol
|
290.50
|
6.1
|
1
|
1
|
20.23
|
4
|
|
|
Pareitropone
|
291.30
|
2.2
|
0
|
4
|
48.42
|
2
|
|
|
Vellosiminol
|
294.40
|
2.1
|
2
|
2
|
39.26
|
1
|
|
|
(1E,4E)-1-(4-Hydroxy-3-methoxyphenyl)-5-(4-hydroxyphenyl)-1,4-pentadien-3-one
|
296.30
|
3.5
|
2
|
4
|
66.76
|
5
|
|
|
(1S)-3-[(3R,4R)-3-ethenylpiperidin-4-yl]-1-quinolin-4-ylpropan-1-ol
|
296.40
|
2.9
|
2
|
3
|
45.15
|
5
|
|
|
Voaphylline
|
296.40
|
3.3
|
1
|
2
|
31.56
|
1
|
|
|
Octacosanoic acid
|
424.70
|
12.9
|
1
|
2
|
37.3
|
26
|
|
|
Aglaithioduline
|
306.40
|
1.9
|
2
|
3
|
83.5
|
9
|
|
|
Kaempferol 3,5-dimethyl ether
|
314.29
|
2.6
|
2
|
6
|
89.13
|
3
|
|
|
Triacontanoic acid
|
452.80
|
13.9
|
1
|
2
|
37.3
|
28
|
|
|
Chloromycorrhizinol A
|
317.20
|
3.6
|
2
|
4
|
62.83
|
0
|
|
|
Paeonilactone C
|
318.32
|
1.2
|
1
|
6
|
89.9
|
4
|
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