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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Cyclomethicone 5
|
370.77
|
|
0
|
5
|
46.15
|
0
|
|
|
Coeloginanthrin
|
286.28
|
3.3
|
3
|
5
|
79.15
|
2
|
|
|
5-Hydroxy-7,2'-dimethoxyflavone
|
298.29
|
2.4
|
1
|
5
|
68.9
|
3
|
|
|
acerogenin B
|
298.40
|
4.1
|
2
|
3
|
49.69
|
0
|
|
|
(2R,4aS,10aR)-7-isopropyl-1,1,4a-trimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-2,6-diol
|
302.50
|
5.2
|
2
|
2
|
40.46
|
1
|
|
|
(8E)-4-methoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3,5,7(20),8,15,18-heptaen-12-one
|
308.40
|
4.2
|
0
|
3
|
35.53
|
1
|
|
|
1-(2,4-Dihydroxy-3-prenylphenyl)-3-(4-hydroxyphenyl)propane
|
312.40
|
5.5
|
3
|
3
|
60.69
|
6
|
|
|
(1'S,2R,4R)-10,11-dimethoxy-5-methylspiro[5-azatricyclo[6.3.1.04,12]dodeca-1(12),8,10-triene-2,6'-cyclohex-2-ene]-1'-ol
|
315.40
|
2.4
|
1
|
4
|
41.93
|
2
|
|
|
5-(beta-D-glucopyranosyloxy)-2-hydroxybenzoic acid
|
316.26
|
-0.8
|
6
|
9
|
156.91
|
4
|
|
|
(+)-Condylocarpine
|
322.40
|
2.3
|
1
|
4
|
41.57
|
2
|
|
|
Phyllaemblic acid C
|
332.35
|
-1.5
|
5
|
8
|
136.68
|
3
|
|
|
Pyrrolidine, 1-(1-oxo-2,4-octadecadienyl)-, (E,E)-
|
333.60
|
8.1
|
0
|
1
|
20.31
|
14
|
|
|
Acronyculatin C
|
334.40
|
4.8
|
2
|
5
|
83.83
|
7
|
|
|
acanthokoreoic acid A
|
334.40
|
3
|
2
|
4
|
74.6
|
2
|
|
|
Brosimacutin D
|
340.40
|
2.6
|
2
|
5
|
75.99
|
1
|
|
|
D-myo-Inositol, 3-O-alpha-D-galactopyranosyl-
|
342.30
|
-5.3
|
9
|
11
|
200.53
|
3
|
|
|
Citrusin D
|
342.34
|
-0.3
|
5
|
8
|
128.84
|
6
|
|
|
(3R,5R)-1,7-bis(4-methoxyphenyl)heptane-3,5-diol
|
344.40
|
3.9
|
2
|
4
|
58.92
|
10
|
|
|
[(1S,2S,4aR,8aR)-2-(1,3-benzodioxol-5-yl)-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-pyrrolidin-1-ylmethanone
|
353.50
|
4.6
|
0
|
3
|
38.77
|
2
|
|
|
(2R,3S,3aS)-2-(3,4-dimethoxyphenyl)-3a-methoxy-3-methyl-5-prop-2-enyl-2,3-dihydro-1-benzofuran-6-one
|
356.40
|
3.2
|
0
|
5
|
53.99
|
6
|
|
|
5-Hydroxy-8-(4-hydroxy-3-methoxyphenyl)-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b']dipyran-6-one
|
366.40
|
3.9
|
2
|
6
|
89.13
|
2
|
|
|
Suchilactone
|
368.40
|
3.7
|
0
|
6
|
63.22
|
5
|
|
|
(2R,3R,4S,5S,6R)-2-[[(1S,2R,3R,5R,8R)-3-hydroxy-8-[(3R)-3-hydroxybutyl]-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
406.50
|
-1.2
|
6
|
9
|
149.07
|
6
|
|
|
Garcimangosone C
|
412.40
|
4.4
|
4
|
7
|
120.36
|
2
|
|
|
(5Z)-4-methoxy-3-methyl-5-[(1S,2R,3S,11S)-3-methyl-11-[(2S,4S)-4-methyl-5-oxooxolan-2-yl]-5-oxa-10-azatricyclo[8.3.0.02,6]tridec-6-en-4-ylidene]furan-2-one
|
415.50
|
2.7
|
0
|
7
|
74.3
|
2
|
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