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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
3-(2-hydroxy-4-methoxyphenyl)-2H-chromen-7-ol
|
270.28
|
2.7
|
2
|
4
|
58.92
|
2
|
|
|
CID 10378473
|
271.24
|
2.8
|
1
|
4
|
59.67
|
2
|
|
|
2,3,4,5,6-Pentafluoro-2',3'-dimethyl-biphenyl
|
272.21
|
4.8
|
0
|
5
|
0
|
1
|
|
|
methyl (114C)hexadecanoate
|
272.44
|
7.9
|
0
|
2
|
26.3
|
15
|
|
|
(9Z,11E,13E,15Z)-(114C)octadeca-9,11,13,15-tetraenoic acid
|
278.40
|
5.9
|
1
|
2
|
37.3
|
12
|
|
|
Dihydroparadol
|
280.40
|
4.3
|
2
|
3
|
49.69
|
10
|
|
|
Michelalbine
|
281.30
|
1.7
|
2
|
4
|
50.72
|
0
|
|
|
(3s)-3-(beta-d-Glucopyranosyloxy)-4-hydroxybutanoic acid
|
282.24
|
-3.2
|
6
|
9
|
156.91
|
6
|
|
|
Cryptocaryone
|
282.29
|
2.6
|
1
|
4
|
63.6
|
2
|
|
|
Ekeberginine
|
293.40
|
4.7
|
1
|
2
|
42.09
|
4
|
|
|
3-hydroxy-2-(1-hydroxyethyl)-7,12-dihydro-6H-indolo[2,3-a]quinolizin-4-one
|
296.32
|
1.7
|
3
|
3
|
78.25
|
1
|
|
|
Hexadecanoic acid propylamide
|
297.50
|
7.8
|
1
|
1
|
29.1
|
16
|
|
|
Tithonine
|
298.29
|
3.6
|
1
|
5
|
68.9
|
3
|
|
|
(R)-Isomucronulatol
|
302.32
|
2.9
|
2
|
5
|
68.15
|
3
|
|
|
Meciadanol
|
304.29
|
0.9
|
4
|
6
|
99.38
|
2
|
|
|
(1S,2R,4aS,4bR,7S,10aS)-7-ethenyl-1-(hydroxymethyl)-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthren-2-ol
|
304.50
|
4.8
|
2
|
2
|
40.46
|
2
|
|
|
(2E,6E)-2,6-dimethyl-8-(2-oxochromen-7-yl)oxyocta-2,6-dienal
|
312.40
|
3.9
|
0
|
4
|
56.51
|
7
|
|
|
Butyl 3-hydroxybutanoate
|
160.21
|
1
|
1
|
3
|
46.53
|
6
|
|
|
(1S,4S,5R,9S,10R,13S,14S)-5-formyl-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-14-carboxylic acid
|
318.40
|
4.7
|
1
|
3
|
54.37
|
2
|
|
|
Erythrinin A
|
320.30
|
3.7
|
1
|
4
|
59.67
|
1
|
|
|
2,3,4,4a,5,6,7,8-Octahydro-4,4a-dimethyl-6-(1-methylvinyl)-2-naphthol
|
220.35
|
3.9
|
1
|
1
|
20.23
|
1
|
|
|
(Z)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-(4-hydroxyphenyl)prop-2-enamide
|
322.40
|
2.2
|
4
|
3
|
85.35
|
5
|
|
|
Carbazoquinocin E
|
323.40
|
5.3
|
1
|
2
|
49.93
|
6
|
|
|
Demethoxykanugin
|
326.30
|
3.1
|
0
|
6
|
67.13
|
3
|
|
|
2-[(8S)-2-oxo-8,9-dihydrofuro[2,3-h]chromen-8-yl]propan-2-yl (E)-2-methylbut-2-enoate
|
328.40
|
3.7
|
0
|
5
|
65.74
|
4
|
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