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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(2-Hydroxyphenyl)methyl 1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate
|
262.26
|
1.3
|
2
|
5
|
83.83
|
4
|
|
|
Bis(1,3)benzodioxolo(5,6-a:4',5'-g)quinolizinium, 6,7-dihydro-13-methyl-
|
334.30
|
3.9
|
0
|
4
|
40.8
|
0
|
|
|
(1aR,3aR,4R,5R,5'R,7aS,7bS)-5'-(furan-3-yl)-3a-hydroxy-5,7a,7b-trimethylspiro[2,3,5,6-tetrahydro-1aH-naphtho[1,2-b]oxirene-4,3'-oxolane]-2',7-dione
|
360.40
|
0.9
|
1
|
6
|
89.27
|
1
|
|
|
[(1S,2S,3S,6R)-2-[(3R)-3-[(3R,5R)-5-(furan-3-yl)-2-oxooxolan-3-yl]butyl]-1,2-dimethyl-7-oxabicyclo[4.1.0]heptan-3-yl] (Z)-2-methylbut-2-enoate
|
430.50
|
4.7
|
0
|
6
|
78.27
|
8
|
|
|
[(3R,4R,5R,6R)-4,5-dihydroxy-6-[5-[4-(2-hydroxypropan-2-yl)cyclohexen-1-yl]-2-methylpentoxy]oxan-3-yl] (E)-2-methyl-5-(4-propan-2-ylphenyl)pent-2-enoate
|
586.80
|
6
|
3
|
7
|
105.45
|
15
|
|
|
Dammara-20(21),24-diene-3-one
|
424.70
|
9.6
|
0
|
1
|
17.07
|
4
|
|
|
(1S,2R,4aS,6aR,6aS,6bR,8aR,11R,12aR,14bS)-11-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
|
470.70
|
6.5
|
2
|
4
|
74.6
|
1
|
|
|
[3,6,9-Trimethylidene-2-oxo-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] 2-(4-hydroxyphenyl)acetate
|
558.60
|
0.6
|
5
|
11
|
172.21
|
7
|
|
|
3a-hydroxy-3,5a,9-trimethyl-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5,6,7,8,9b-hexahydro-3H-benzo[g][1]benzofuran-2-one
|
428.50
|
-1.1
|
5
|
9
|
145.91
|
3
|
|
|
Sphaeranthanolide
|
428.50
|
-1.1
|
5
|
9
|
145.91
|
3
|
|
|
3-Methylidene-5-[2-methyl-4-(4-methylidene-5-oxooxolan-3-yl)-3-oxobutyl]oxolan-2-one
|
278.30
|
1.6
|
0
|
5
|
69.67
|
5
|
|
|
(1S,2S,6S,7S,9R,11S,13S,14R,15S,16S,17S)-16-hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-11-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-3-one
|
556.60
|
0.8
|
5
|
11
|
164.37
|
5
|
|
|
[(3aR,4R,5S,5aS,6S,8R,8aS,9R,9aS)-9-acetyloxy-4,8-dihydroxy-5,8a-dimethyl-1-methylidene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-6-yl] (Z)-2-methylbut-2-enoate
|
422.50
|
2.1
|
2
|
8
|
119.36
|
5
|
|
|
[(1R,2R,7R,9R,10R,12S)-1,2,5-Trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-10-yl] acetate
|
292.40
|
1.8
|
0
|
4
|
48.06
|
2
|
|
|
2-methoxy-4-[(E)-2-[(2R)-pyrrolidin-2-yl]ethenyl]phenol
|
219.28
|
2.2
|
2
|
3
|
41.49
|
3
|
|
|
1-(1,3-Benzodioxol-5-yl)-3-(1-piperidinyl)-1-propanone
|
261.32
|
2.2
|
0
|
4
|
38.77
|
4
|
|
|
4,6-O-Benzylidene-D-glucose
|
268.26
|
-0.4
|
3
|
6
|
96.22
|
4
|
|
|
1,7-Bis(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione
|
308.30
|
3.3
|
2
|
4
|
74.6
|
6
|
|
|
4H-1-Benzopyran-4-one, 2,3-dihydro-3,7-dihydroxy-5-methoxy-2-phenyl-, (2R,3R)-
|
286.28
|
2
|
2
|
5
|
75.99
|
2
|
|
|
Kaempferol-3-O-arabinoside
|
418.30
|
0.8
|
6
|
10
|
170.05
|
3
|
|
|
Kaempferol 3-alpha-D-arabinopyranoside
|
418.30
|
0.8
|
6
|
10
|
170.05
|
3
|
|
|
[4-[2-[[(E)-3-(4-acetyloxy-3-methoxyphenyl)prop-2-enoyl]amino]ethyl]phenyl] acetate
|
397.40
|
2.3
|
1
|
6
|
90.93
|
10
|
|
|
Ergosta-4,24(28)-dien-3-one
|
396.60
|
8.6
|
0
|
1
|
17.07
|
5
|
|
|
Ergobalansine
|
521.60
|
1.5
|
4
|
6
|
127
|
4
|
|
|
(6aR,9S)-N-[(2R,5S,8S,8aS)-8a-hydroxy-2,8-dimethyl-5-(2-methylpropyl)-3,6-dioxo-7,8-dihydro-5H-[1,3]oxazolo[3,2-a]pyrazin-2-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
|
521.60
|
1.5
|
4
|
6
|
127
|
4
|
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