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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
5,7-dihydroxy-8-[(2S)-2-hydroxy-3-methylbut-3-enyl]-3-(4-hydroxyphenyl)-6-(3-methylbut-2-enyl)chromen-4-one
|
422.50
|
5.5
|
4
|
6
|
111.13
|
6
|
|
|
(2R)-7-hydroxy-5-methoxy-2-(4-methoxyphenyl)-2,3-dihydrochromen-4-one
|
300.30
|
2.5
|
1
|
5
|
64.99
|
3
|
|
|
4-[(2R)-7-methoxy-8-(3-methylbut-2-enyl)-3,4-dihydro-2H-chromen-2-yl]benzene-1,3-diol
|
340.40
|
5
|
2
|
4
|
58.92
|
4
|
|
|
(2R)-5,7-dihydroxy-2-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
|
476.60
|
8.2
|
3
|
5
|
86.99
|
7
|
|
|
5-Hydroxysophoranone
|
476.60
|
8.2
|
3
|
5
|
86.99
|
7
|
|
|
(1S,13R)-7,7-dimethyl-8,12,20-trioxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-2(11),3,5,9,14(19),15,17-heptaene-1,17-diol
|
338.40
|
2.5
|
2
|
5
|
68.15
|
0
|
|
|
CID 124356
|
526.50
|
0.1
|
1
|
10
|
137.96
|
0
|
|
|
(3R,6R)-2,2,6-trimethyl-6-[(1R)-4-methylcyclohex-3-en-1-yl]oxan-3-ol
|
238.37
|
2.5
|
1
|
2
|
29.46
|
1
|
|
|
(5R)-4,5-dimethyl-8-oxo-6,7-dihydro-5H-benzo[f][1]benzofuran-3-carbaldehyde
|
242.27
|
2.6
|
0
|
3
|
47.28
|
1
|
|
|
(2S)-6-(3,4-dihydroxyphenyl)-4-hydroxy-2-(2-hydroxypropan-2-yl)-9-(3-methylbut-2-enyl)-2,3-dihydrofuro[3,2-g]chromen-5-one
|
438.50
|
4.6
|
4
|
7
|
120.36
|
4
|
|
|
[(4S,6R)-6-acetyloxy-8-(4-hydroxy-3-methoxyphenyl)octan-4-yl] acetate
|
352.40
|
3
|
1
|
6
|
82.06
|
12
|
|
|
[(4R,6S)-6-acetyloxy-8-(4-hydroxy-3-methoxyphenyl)octan-4-yl] acetate
|
352.40
|
3
|
1
|
6
|
82.06
|
12
|
|
|
[(3S,5S)-3-acetyloxy-1-(4-hydroxy-3-methoxyphenyl)decan-5-yl] acetate
|
380.50
|
4.8
|
1
|
6
|
82.06
|
14
|
|
|
3-Hydroxy-5-methyl-2,5-dihydrofuran-2-one
|
114.10
|
0.5
|
1
|
3
|
46.53
|
0
|
|
|
1,1,3,3-Tetrachloroacetone
|
195.90
|
2.6
|
0
|
1
|
17.07
|
2
|
|
|
Glucogallin
|
332.26
|
-1.3
|
6
|
10
|
166.14
|
4
|
|
|
Methyl 4-(acetyloxy)-15-[3-formyl-7-(methoxycarbonyl)-5-(2-oxobutyl)-1,2,3,4,5,6,7,8-octahydroazonino[5,4-b]indol-7-yl]-3-hydroxy-16-methoxy-1-methyl-6,7-didehydroaspidospermidine-3-carboxylate
|
825.00
|
3.1
|
2
|
12
|
168.01
|
12
|
|
|
(5S,8S,9S,10S,11S,14R)-17-[(2R,4S)-4-[(2R)-3,3-dimethyloxiran-2-yl]-4-hydroxybutan-2-yl]-11-hydroxy-4,4,8,10,14-pentamethyl-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-3-one
|
472.70
|
4.8
|
2
|
4
|
70.06
|
4
|
|
|
(2S,3S,10S)-2-hydroxy-3-[(1S)-1-hydroxyheptyl]-10-[(R)-hydroxy-[(2R)-6-oxo-2,3-dihydropyran-2-yl]methyl]-6,14-dioxatricyclo[10.3.0.04,8]pentadeca-1(12),4(8)-diene-5,7,13,15-tetrone
|
518.50
|
2
|
3
|
11
|
173.73
|
8
|
|
|
(2R)-N-[(2S)-1-[(1R,9R,10R,11S,12S)-1,12-dihydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-11-carbonyl]pyrrolidin-2-yl]-2-methylbutanamide
|
630.70
|
4.2
|
3
|
8
|
126.79
|
9
|
|
|
[(2R)-2,3-dihydroxypropyl] (9Z,12E)-octadeca-9,12-dienoate
|
354.50
|
5.8
|
2
|
4
|
66.76
|
18
|
|
|
(E)-4-isothiocyanato-1-[(S)-methylsulfinyl]but-1-ene
|
175.30
|
1.5
|
0
|
4
|
80.73
|
4
|
|
|
[(1R,10S,12R,13E,14R,16S,17S,18R)-13-ethylidene-14-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
|
512.60
|
-0.2
|
4
|
10
|
141.28
|
5
|
|
|
21-Deoxyvomilenine
|
334.40
|
1.9
|
0
|
4
|
41.9
|
2
|
|
|
(1R,2R,4S,7R,8S,11R,12R,18R)-7-[(2R)-2-hydroxy-5-oxo-2H-furan-4-yl]-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icos-13-ene-5,15,20-trione
|
486.50
|
1.8
|
1
|
9
|
128.73
|
1
|
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