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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
6-O-Galloylalbiflorin
|
632.60
|
-0.4
|
7
|
15
|
238.97
|
10
|
|
|
Octacosane
|
394.80
|
14.8
|
0
|
0
|
0
|
25
|
|
|
Nonacosane
|
408.80
|
15.3
|
0
|
0
|
0
|
26
|
|
|
793Mxb4leg
|
140.22
|
2.7
|
0
|
1
|
17.07
|
5
|
|
|
Hentriacontane
|
436.80
|
16.4
|
0
|
0
|
0
|
28
|
|
|
1a,2,7,7a-Tetrahydro-1a-methyl-7a-(3,7,11,15-tetramethyl-2-hexadecen-1-yl)naphth[2,3-b]oxirene-2,7-diol
|
470.70
|
8.9
|
2
|
3
|
52.99
|
14
|
|
|
Tritriacontane
|
464.90
|
17.5
|
0
|
0
|
0
|
30
|
|
|
(E)-3-[(2S,3S)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-3-methyl-2,3-dihydro-1-benzofuran-5-yl]prop-2-enal
|
340.40
|
3.3
|
1
|
5
|
64.99
|
5
|
|
|
Hexatriacontane
|
507.00
|
19.1
|
0
|
0
|
0
|
33
|
|
|
5-Azulenemethanol
|
158.20
|
2
|
1
|
1
|
20.23
|
1
|
|
|
(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
|
482.40
|
-0.7
|
9
|
13
|
226.83
|
4
|
|
|
Pentatriacontane
|
492.90
|
18.6
|
0
|
0
|
0
|
32
|
|
|
1-[(2S)-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-5-yl]ethanone
|
202.25
|
2.9
|
0
|
2
|
26.3
|
2
|
|
|
(R)-Bitalin A
|
218.25
|
1.7
|
1
|
3
|
46.53
|
3
|
|
|
5-(hydroxymethyl)-1H-pyrrole-2-carbaldehyde
|
125.13
|
-0.3
|
2
|
2
|
53.09
|
2
|
|
|
Dibenzyltetrasulfid
|
310.50
|
4.8
|
0
|
4
|
101.2
|
7
|
|
|
1-Amino-5-benzoyloxypentane
|
207.27
|
2.7
|
1
|
3
|
52.32
|
7
|
|
|
5,6-Dimethyl-3,4-dihydro-2H-pyran-2-one
|
126.15
|
0.8
|
0
|
2
|
26.3
|
0
|
|
|
(2E,5E)-hepta-2,5-dien-1-ol
|
112.17
|
1.4
|
1
|
1
|
20.23
|
3
|
|
|
Cupresol
|
332.40
|
4.8
|
1
|
4
|
55.76
|
2
|
|
|
Pharmakon1600-01500676
|
584.70
|
-1.7
|
8
|
12
|
206.6
|
4
|
|
|
5-Oxoleurosine
|
822.90
|
3.2
|
2
|
12
|
163.47
|
10
|
|
|
Ajacusine
|
772.90
|
2.7
|
2
|
12
|
161.37
|
12
|
|
|
Urolithin A-3-O-glucuronide
|
404.30
|
0.8
|
5
|
10
|
166.89
|
3
|
|
|
3,4-Dhpea-EA
|
378.40
|
1.1
|
3
|
8
|
122.52
|
8
|
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