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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
2-(3,4-Dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl-D-glucopyranoside
|
448.40
|
0.5
|
7
|
11
|
190.28
|
4
|
|
|
2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
448.40
|
0.5
|
7
|
11
|
190.28
|
4
|
|
|
2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2S,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
448.40
|
0.5
|
7
|
11
|
190.28
|
4
|
|
|
(E)-3-Methyl-3-pentenoic acid methyl ester
|
128.17
|
1.7
|
0
|
2
|
26.3
|
3
|
|
|
Corchorusin D
|
781.00
|
3.2
|
8
|
13
|
207.99
|
6
|
|
|
(2R,3S,4S,5R)-3-(hydroxymethyl)oxane-2,3,4,5-tetrol
|
180.16
|
-2.8
|
5
|
6
|
110.38
|
1
|
|
|
Methyl 2-(ethylamino)benzoate
|
179.22
|
2.7
|
1
|
3
|
38.33
|
4
|
|
|
2,3-Epoxy-1,2,3,4-tetrahydronaphthalene-c-1,c-4,8-triol
|
194.18
|
-0.6
|
3
|
4
|
73.22
|
0
|
|
|
(1R,3S,5R,6R)-7,7-dimethyl-2-methylidenebicyclo[3.1.1]heptane-3,6-diol
|
168.23
|
0.6
|
2
|
2
|
40.46
|
0
|
|
|
(1S,2R,4R,5S)-5-(hydroxymethyl)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
|
184.27
|
1.5
|
2
|
2
|
40.46
|
1
|
|
|
3-[(2-Hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl)amino]propanoic acid
|
299.21
|
-2.2
|
5
|
8
|
163.2
|
8
|
|
|
(5S,6S)-5-hydroxy-3-methyl-6-propan-2-ylcyclohex-3-en-1-one
|
168.23
|
0.9
|
1
|
2
|
37.3
|
1
|
|
|
(6S,7S)-7-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-6-ol
|
149.19
|
0.9
|
1
|
2
|
33.12
|
0
|
|
|
(3S)-5,8-dihydroxy-3-methyl-3,4-dihydroisochromen-1-one
|
194.18
|
2.1
|
2
|
4
|
66.76
|
0
|
|
|
Panasinsanol B
|
222.37
|
4
|
1
|
1
|
20.23
|
0
|
|
|
(Z)-5-Hexadecenoic acid
|
254.41
|
6.2
|
1
|
2
|
37.3
|
13
|
|
|
5Z-hexadecenoic acid
|
254.41
|
6.2
|
1
|
2
|
37.3
|
13
|
|
|
2,6-Dideoxy-3-O-ethyl-alpha-L-arabino-Hexopyranose
|
176.21
|
-0.2
|
2
|
4
|
58.92
|
2
|
|
|
(1R,2R,4R,7S)-7-aminocycloheptane-1,2,4-triol
|
161.20
|
-1.7
|
4
|
4
|
86.71
|
0
|
|
|
(1R,5R)-5-hydroxy-2,2,4-trimethylcyclohex-3-ene-1-carbaldehyde
|
168.23
|
0.9
|
1
|
2
|
37.3
|
1
|
|
|
(2R)-3-[(2S,3S,4R)-3,4-dihydroxy-5-oxooxolan-2-yl]-2-hydroxypropanoic acid
|
206.15
|
-2
|
4
|
7
|
124.29
|
3
|
|
|
(4aR,6S,7aR)-6-hydroxy-2,4a,7a-trimethyl-6,7-dihydro-5H-cyclopenta[b]pyran-4-one
|
196.24
|
0.8
|
1
|
3
|
46.53
|
0
|
|
|
(4R)-tetradecan-4-ol
|
214.39
|
6
|
1
|
1
|
20.23
|
11
|
|
|
3-(4-((3,7-Dimethylocta-2,6-dien-1-yl)oxy)-3-methoxyphenyl)prop-2-en-1-ol
|
316.40
|
5
|
1
|
3
|
38.69
|
9
|
|
|
(1S,2R,4S)-5,6-dimethylbicyclo[2.2.1]hept-5-en-2-ol
|
138.21
|
0.7
|
1
|
1
|
20.23
|
0
|
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