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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
2-Ethenylphenol
|
120.15
|
2.3
|
1
|
1
|
20.23
|
1
|
|
|
garcinianone B
|
464.50
|
6.8
|
3
|
6
|
107.97
|
7
|
|
|
Acid orange 7
|
350.30
|
|
1
|
6
|
110.53
|
3
|
|
|
2,6-Diamino-5-(beta-D-glucopyranosyloxy)-4(1H)-pyrimidinone
|
304.26
|
-3.7
|
7
|
9
|
197.17
|
3
|
|
|
Neotheaflavin 3-gallate
|
716.60
|
3.5
|
11
|
16
|
284.36
|
5
|
|
|
2,3,5,7-Tetrahydroxy-1,4-naphthalenedione
|
222.15
|
1
|
4
|
6
|
115.06
|
0
|
|
|
Betanidin
|
388.30
|
0.6
|
5
|
10
|
167.96
|
5
|
|
|
10-Formyltetrahydropteroylglutamic acid
|
473.40
|
-1.2
|
7
|
10
|
219.84
|
9
|
|
|
3,4,5-trihydroxy-6-oxo-1-(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)benzo[7]annulene-8-carboxylic acid
|
428.30
|
1.9
|
7
|
10
|
184.98
|
2
|
|
|
Norrubrofusarin
|
258.23
|
0.4
|
3
|
5
|
90.9
|
0
|
|
|
Cascarin
|
416.40
|
1.4
|
5
|
9
|
153.75
|
2
|
|
|
Ismailin
|
536.50
|
4.7
|
3
|
9
|
155.25
|
2
|
|
|
Ancistrocladeine
|
403.50
|
5.7
|
1
|
5
|
60.81
|
4
|
|
|
Luotonin F
|
301.30
|
2.5
|
1
|
4
|
75.71
|
2
|
|
|
[(2R,3R)-5,7-dihydroxy-2-[3,4,6-trihydroxy-5-oxo-8-[(2R,3R)-3,5,7-trihydroxychroman-2-yl]benzo[7]annulen-1-yl]chroman-3-yl] 3,4,5-trihydroxybenzoate
|
716.60
|
3.5
|
11
|
16
|
284.36
|
5
|
|
|
Methyl 3-methyl-2-butenoate
|
114.14
|
1.6
|
0
|
2
|
26.3
|
2
|
|
|
Guanosine-2'-monophosphate
|
363.22
|
-3
|
6
|
10
|
215.85
|
4
|
|
|
6-benzylamino-3-beta-D-glucopyranosylpurine
|
387.40
|
-0.7
|
5
|
7
|
149.01
|
4
|
|
|
Fosdenopterin
|
363.22
|
-4
|
7
|
11
|
211.09
|
0
|
|
|
Thelephoric acid
|
352.20
|
2.9
|
4
|
8
|
141.34
|
0
|
|
|
Benzo[h]quinazolin-4(1H)-one
|
196.20
|
2
|
1
|
2
|
45.75
|
0
|
|
|
(10S)-Hydroxypheophytin a
|
887.20
|
11
|
3
|
10
|
142.17
|
22
|
|
|
Succinimide, monooxime
|
114.10
|
-0.8
|
2
|
3
|
61.69
|
0
|
|
|
garcinianone A
|
464.50
|
6.8
|
3
|
6
|
107.97
|
7
|
|
|
(10S)-Hydroxypheophorbide a
|
608.70
|
2
|
4
|
10
|
153.17
|
7
|
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