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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Carbazoquinocin C
|
309.40
|
5.1
|
1
|
2
|
49.93
|
6
|
|
|
1,3,5-Trihydroxy-4-(3-methylbut-2-en-1-yl)-9H-xanthen-9-one
|
312.30
|
4.4
|
3
|
5
|
90.9
|
2
|
|
|
(2S)-5,7-Dimethoxy-8-formylflavanone
|
312.30
|
2.3
|
0
|
5
|
61.83
|
4
|
|
|
3,3',4,5'-Tetrahydroxy-5-prenylbibenzyl
|
314.40
|
4.6
|
4
|
4
|
80.92
|
5
|
|
|
(3S,5S)-1,7-bis(4-hydroxyphenyl)heptane-3,5-diol
|
316.40
|
3.3
|
4
|
4
|
80.92
|
8
|
|
|
helioscopinolide B
|
316.40
|
3.2
|
1
|
3
|
46.53
|
0
|
|
|
Sollasin D
|
316.40
|
5.3
|
0
|
3
|
39.44
|
5
|
|
|
2-Methyl-2-butenal
|
84.12
|
0.9
|
0
|
1
|
17.07
|
1
|
|
|
Shinpterocarpin
|
322.40
|
3.6
|
1
|
4
|
47.92
|
0
|
|
|
Preracemosol B
|
326.40
|
4.4
|
3
|
4
|
69.92
|
3
|
|
|
2,9-dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-3,10-diol
|
327.40
|
2.6
|
2
|
5
|
62.16
|
2
|
|
|
13-Hydroxy-12-methoxy-3,5,10,17-tetraoxapentacyclo[9.6.2.02,6.08,18.015,19]nonadeca-1(18),2(6),7,11(19),12,14-hexaene-9,16-dione
|
328.23
|
2
|
1
|
8
|
108.34
|
1
|
|
|
1-[3-methoxy-4-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]ethanone
|
328.31
|
-1.4
|
4
|
8
|
125.68
|
5
|
|
|
(2S)-5,7-Dimethoxy-3',4'-methylenedioxyflavanone
|
328.30
|
2.7
|
0
|
6
|
63.22
|
3
|
|
|
Piperogalin
|
328.50
|
7.3
|
2
|
2
|
40.46
|
7
|
|
|
(2R,3R)-2-(Benzo[d][1,3]dioxol-5-yl)-5,7-dimethoxychroman-3-ol
|
330.30
|
2.6
|
1
|
6
|
66.38
|
3
|
|
|
[(3aR,4R,5E,7Z,10Z,11aR)-6-formyl-10-methyl-3-methylidene-2-oxo-3a,4,9,11a-tetrahydrocyclodeca[b]furan-4-yl] 2-methylpropanoate
|
330.40
|
2.7
|
0
|
5
|
69.67
|
4
|
|
|
(3aR,6E,10Z,14E,15aS)-6,14-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid
|
330.40
|
2.7
|
1
|
4
|
63.6
|
1
|
|
|
R-Coluteol
|
332.30
|
2.9
|
2
|
6
|
77.38
|
4
|
|
|
(1S,2R,10R,11R,12R,13R,16R)-12-hydroxy-2,6,10,16-tetramethyl-9,14-dioxatetracyclo[11.2.1.02,11.05,10]hexadeca-4,6-diene-3,8,15-trione
|
332.30
|
0.2
|
1
|
6
|
89.9
|
0
|
|
|
[(9Z)-11,16-dihydroxyoctadeca-9,17-dien-12,14-diynyl] acetate
|
332.40
|
3.9
|
2
|
4
|
66.76
|
13
|
|
|
Bavachinin
|
338.40
|
4.4
|
1
|
4
|
55.76
|
4
|
|
|
2'-Hydroxy-2,3,4',6'-tetramethoxychalcone
|
344.40
|
3.8
|
1
|
6
|
74.22
|
7
|
|
|
3',5,5',7-Tetrahydroxy-4',6-dimethoxyflavone
|
346.30
|
2.3
|
4
|
8
|
129.59
|
3
|
|
|
[(4S,6aR,9aR,9bR)-8-hydroxy-3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] 2-(hydroxymethyl)prop-2-enoate
|
346.40
|
0.6
|
2
|
6
|
93.06
|
4
|
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