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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1R,2R,4S)-rel-
|
204.35
|
6.1
|
0
|
0
|
0
|
3
|
|
|
(1S,3R,4R)-3-(hydroxymethyl)-1-oxodithiolan-4-ol
|
168.20
|
-1
|
2
|
5
|
102.04
|
1
|
|
|
6-Methoxy-7-methyl-8-oxoguanine
|
195.18
|
-0.7
|
2
|
5
|
98.82
|
1
|
|
|
(1R,2S,5R,6R,7R,8S)-1,5-dimethyl-8-prop-1-en-2-yltricyclo[5.3.0.02,6]decane
|
204.35
|
5.5
|
0
|
0
|
0
|
1
|
|
|
Eremopetasinorone A
|
206.28
|
1.8
|
0
|
2
|
34.14
|
1
|
|
|
3,4-Dihydroxyphenyllactic acid methyl ester
|
212.20
|
0
|
3
|
5
|
86.99
|
4
|
|
|
(E)-2-methyl-4-[(2-tritio-7H-purin-6-yl)amino]but-2-en-1-ol
|
221.25
|
0.7
|
3
|
5
|
86.72
|
4
|
|
|
(4aR,5R,9aR)-1,1,4a,8-Tetramethyl-2,3,4,4a,5,6,7,9a-octahydro-1H-benzo[7]annulen-5-ol
|
222.37
|
3.9
|
1
|
1
|
20.23
|
0
|
|
|
4-[(1S,3S,5R,8R)-3-hydroxy-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-8-yl]butan-2-one
|
226.31
|
0.9
|
1
|
3
|
46.53
|
3
|
|
|
(E)-3-[(1R,4R,6S)-1,4-dihydroxy-2,2,6-trimethylcyclohexyl]prop-2-enoic acid
|
228.28
|
1.1
|
3
|
4
|
77.76
|
2
|
|
|
9-Hydroxy-7-oxofuro[3,2-g]chromene-4-carbaldehyde
|
230.17
|
1.4
|
1
|
5
|
80.65
|
1
|
|
|
Ethanone, 1-(1-hydroxy-8-methoxy-3-methyl-2-naphthalenyl)-
|
230.26
|
3.4
|
1
|
3
|
46.53
|
2
|
|
|
alpha-Bisabolol
|
222.37
|
3.8
|
1
|
1
|
20.23
|
4
|
|
|
Benzyl 2,6-dihydroxybenzoate
|
244.24
|
3.1
|
2
|
4
|
66.76
|
4
|
|
|
5-Undecylbenzene-1,3-diol
|
264.40
|
6.9
|
2
|
2
|
40.46
|
10
|
|
|
3-[(E)-3-hydroxy-3-methylbut-1-enyl]-4-methoxy-1-methylquinolin-2-one
|
273.33
|
1.6
|
1
|
3
|
51.46
|
3
|
|
|
(1R,2R,5S,9S,10S,11S)-2-hydroxy-2,11-dimethyl-6-methylidene-8,12,13-trioxatetracyclo[9.2.2.01,10.05,9]pentadec-14-en-7-one
|
278.30
|
0.9
|
1
|
5
|
64.99
|
0
|
|
|
dihydrobuddledin A
|
278.40
|
3.7
|
0
|
3
|
43.37
|
2
|
|
|
Flakinin A
|
280.32
|
1.4
|
1
|
5
|
72.83
|
1
|
|
|
4-hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylic acid
|
129.11
|
-1.1
|
2
|
4
|
69.89
|
1
|
|
|
[(1R,2R)-2-(2-hydroxyethyl)-3,4-bis(hydroxymethyl)cyclopent-3-en-1-yl] 4-hydroxybenzoate
|
308.33
|
-0.6
|
4
|
6
|
107.22
|
7
|
|
|
1,3,6-Trihydroxy-4-(3-methylbut-2-enyl)xanthen-9-one
|
312.30
|
4.4
|
3
|
5
|
90.9
|
2
|
|
|
Nlcamzutwgfusw-uhfffaoysa-
|
314.29
|
2.8
|
0
|
6
|
63.22
|
3
|
|
|
(1S,2S)-2-Hydroxy-1-(4-methoxyphenyl)propyl 4-methoxybenzoate
|
316.30
|
3
|
1
|
5
|
64.99
|
7
|
|
|
7-Hydroxy-3,4',8-trimethoxyflavone
|
328.30
|
2.9
|
1
|
6
|
78.13
|
4
|
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