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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Tris(2,4-ditert-butylphenyl)phosphate
|
662.90
|
15
|
0
|
4
|
54.57
|
12
|
|
|
Proline
|
115.13
|
-2.5
|
2
|
3
|
49.33
|
1
|
|
|
Eicosyl trifluoroacetate
|
394.60
|
11
|
0
|
5
|
26.3
|
20
|
|
|
Glucohesperalin
|
465.60
|
-1.2
|
5
|
13
|
236.07
|
12
|
|
|
9-Azabicyclo[3.3.1]nonan-3-one
|
139.19
|
0.2
|
1
|
2
|
29.1
|
0
|
|
|
Homomoschatoline
|
321.30
|
3.5
|
0
|
5
|
57.65
|
3
|
|
|
Tetramethoxychalcone
|
328.40
|
3.6
|
0
|
5
|
53.99
|
7
|
|
|
Guaiacylglycerol
|
214.21
|
-0.6
|
4
|
5
|
90.15
|
4
|
|
|
D-glutamine
|
146.14
|
-3.1
|
3
|
4
|
106.41
|
4
|
|
|
Methyl 10-methylene-9-oxooctadecanoate
|
324.50
|
6.7
|
0
|
3
|
43.37
|
17
|
|
|
Methyl 9-methylene-8-oxoheptadecanoate
|
310.50
|
6.1
|
0
|
3
|
43.37
|
16
|
|
|
CID 14583168
|
380.40
|
-1.9
|
5
|
8
|
144.52
|
1
|
|
|
Gibberellin A75
|
380.40
|
-1.9
|
5
|
8
|
144.52
|
1
|
|
|
5,7,13-Trihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid
|
364.40
|
-0.9
|
4
|
7
|
124.29
|
1
|
|
|
Gibberellin A76
|
364.40
|
-0.9
|
4
|
7
|
124.29
|
1
|
|
|
4-Methyl-2(5H)-furanone
|
98.10
|
0.1
|
0
|
2
|
26.3
|
0
|
|
|
Spiranthesol
|
618.80
|
9.8
|
4
|
6
|
99.38
|
7
|
|
|
Oovavljiumkkqs-uhfffaoysa-
|
324.40
|
3.7
|
1
|
4
|
63.6
|
3
|
|
|
2-(2-Hydroxypropan-2-yl)-7-methoxy-2,3,4,5-tetrahydronaphtho[2,1-e][1]benzofuran-9-ol
|
326.40
|
3.5
|
2
|
4
|
58.92
|
2
|
|
|
7-[(4-Hydroxyphenyl)methyl]-8-methoxy-2,2-dimethyl-3,4,5,6-tetrahydronaphtho[2,1-f]chromen-10-ol
|
416.50
|
6
|
2
|
4
|
58.92
|
3
|
|
|
Plumerinine
|
225.37
|
3.3
|
1
|
2
|
23.47
|
1
|
|
|
(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
|
398.70
|
9
|
0
|
1
|
17.07
|
5
|
|
|
Stigmast-24(28)-en-3-one, (5alpha)-
|
412.70
|
9.3
|
0
|
1
|
17.07
|
5
|
|
|
1-[(7-Hydroxy-4-methoxy-9,10-dihydrophenanthren-2-yl)oxy]-4-methoxy-9,10-dihydrophenanthrene-2,7-diol
|
482.50
|
6.2
|
3
|
6
|
88.38
|
4
|
|
|
1-[(5-Hydroxy-7-methoxy-9,10-dihydrophenanthren-2-yl)oxy]-4-methoxy-9,10-dihydrophenanthrene-2,7-diol
|
482.50
|
6.2
|
3
|
6
|
88.38
|
4
|
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