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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
N-acetylglucosaminylasparagine
|
335.31
|
-5.7
|
7
|
9
|
191.44
|
6
|
|
|
N,N-Dimethylarginine
|
202.25
|
-3.6
|
3
|
4
|
104.94
|
6
|
|
|
cyclic ADP-ribose
|
541.30
|
-5.7
|
7
|
16
|
280.78
|
0
|
|
|
(1S,4R,6S,11R,12S)-14,16-dihydroxy-1,5,5,8-tetramethyl-12-(2-methylpropyl)-19-oxatetracyclo[9.8.0.04,6.013,18]nonadeca-7,13,15,17-tetraene-15,17-dicarbaldehyde
|
454.60
|
6.6
|
2
|
5
|
83.83
|
4
|
|
|
Dibutyl disulfide
|
178.40
|
3.4
|
0
|
2
|
50.6
|
7
|
|
|
15-Oxo-octacosanoic acid
|
438.70
|
10.5
|
1
|
3
|
54.37
|
26
|
|
|
5-Hydroxy-2-methyl-2,3,4,5-tetrahydrooxecin-10-one
|
182.22
|
1.5
|
1
|
3
|
46.53
|
0
|
|
|
(1S,2S)-1-(4-methoxyphenyl)propane-1,2-diol
|
182.22
|
0.8
|
2
|
3
|
49.69
|
3
|
|
|
Topaquinone
|
211.17
|
-4.1
|
3
|
6
|
117.69
|
3
|
|
|
Bruceolline D
|
199.25
|
2.4
|
1
|
1
|
32.86
|
0
|
|
|
[(S)-methylsulfinyl]sulfanylmethane
|
110.20
|
-0.1
|
0
|
3
|
61.58
|
1
|
|
|
Tridecane
|
184.36
|
6.6
|
0
|
0
|
0
|
10
|
|
|
5-Hydroxy-2-[2-(4-hydroxyphenyl)acetyl]-3-methoxybenzoic acid
|
302.28
|
2
|
3
|
6
|
104.06
|
5
|
|
|
Tetradecane
|
198.39
|
7.2
|
0
|
0
|
0
|
11
|
|
|
1,2-Dihydroxypropane-1,2,3-tricarboxylic acid
|
208.12
|
-2.6
|
5
|
8
|
152.36
|
5
|
|
|
[3-(3-Hydroxy-2-phenylpropanoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octan-6-yl] 2-methylpropanoate
|
375.50
|
2.5
|
1
|
6
|
76.07
|
8
|
|
|
Pentadecane
|
212.41
|
7.7
|
0
|
0
|
0
|
12
|
|
|
alpha-D-Galactose 1-phosphate
|
260.14
|
-3.8
|
6
|
9
|
166.72
|
3
|
|
|
Heptyl ether
|
214.39
|
5.8
|
0
|
1
|
9.23
|
12
|
|
|
10-Oxotetracosyl icosanoate
|
663.20
|
19.3
|
0
|
3
|
43.37
|
42
|
|
|
Octaethyleneglycol monododecyl ether
|
538.80
|
4.1
|
1
|
9
|
94.07
|
34
|
|
|
Hexadecyl acetate
|
284.50
|
7.7
|
0
|
2
|
26.3
|
16
|
|
|
l-Alanyl-l-glutamine
|
217.22
|
-4.4
|
4
|
5
|
135.51
|
6
|
|
|
gamma-Glutamylcysteine
|
250.27
|
-3.8
|
5
|
7
|
168.52
|
7
|
|
|
1-Bromopentadecane
|
291.31
|
8.7
|
0
|
0
|
0
|
13
|
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