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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(1R,12R)-15-methoxy-20-methyl-5,7-dioxa-20-azapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-16-ol
|
325.40
|
2.8
|
1
|
5
|
51.16
|
1
|
|
|
(3I(2),13I+/-)-3-Methoxy-13-methyl-27-norolean-14-ene
|
440.70
|
9.8
|
0
|
1
|
9.23
|
1
|
|
|
Furanoelemene
|
216.32
|
4.6
|
0
|
1
|
13.14
|
2
|
|
|
Benzofuran, 6-ethenyl-4,5,6,7-tetrahydro-3,6-dimethyl-5-isopropenyl-, trans-
|
216.32
|
4.6
|
0
|
1
|
13.14
|
2
|
|
|
1-[[4-[5-[(7-hydroxy-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-2-methoxyphenoxy]phenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol
|
610.70
|
6.4
|
2
|
8
|
83.86
|
9
|
|
|
Grisabine
|
610.70
|
6.4
|
2
|
8
|
83.86
|
9
|
|
|
(3R,4S,5R)-4-[(2R,3R)-2,3-dihydroxy-3-[(2S,3R,5R,9R,10R,13R,14S,17S)-2,3,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]butyl]-3,5-dimethyloxolan-2-one
|
520.70
|
1
|
5
|
8
|
144.52
|
4
|
|
|
Cyclamiretin A
|
472.70
|
5.2
|
2
|
4
|
66.76
|
1
|
|
|
Cycloalliin
|
177.22
|
-3.6
|
2
|
5
|
85.61
|
1
|
|
|
(1S,3R,6S,8R,11R,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methylhept-5-en-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol
|
426.70
|
9.8
|
1
|
1
|
20.23
|
4
|
|
|
Cycloartenone
|
424.70
|
9.5
|
0
|
1
|
17.07
|
4
|
|
|
(1S,3R,8R,11R,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methylhept-5-en-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
|
424.70
|
9.5
|
0
|
1
|
17.07
|
4
|
|
|
Buxtamine
|
371.60
|
4.2
|
2
|
3
|
49.33
|
2
|
|
|
Lespedin;Lespenephryl
|
578.50
|
-0.1
|
8
|
14
|
228.97
|
5
|
|
|
5-Hydroxy-2-(4-hydroxyphenyl)-3,7-bis[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy]chromen-4-one
|
578.50
|
-0.1
|
8
|
14
|
228.97
|
5
|
|
|
Kammogenin
|
444.60
|
3
|
2
|
5
|
75.99
|
0
|
|
|
Kanjone
|
292.30
|
3.6
|
0
|
4
|
52.58
|
2
|
|
|
Kanugin
|
356.30
|
3.1
|
0
|
7
|
76.36
|
4
|
|
|
5-Hydroxy-2-(hydroxymethyl)-8-methyl-6,9-dihydropyrano[3,2-h][1]benzoxepin-4-one
|
274.27
|
1.4
|
2
|
5
|
79.9
|
1
|
|
|
11-Deoxoglycyrrhetinic acid
|
456.70
|
7.5
|
2
|
3
|
57.53
|
1
|
|
|
(2S,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid
|
456.70
|
7.5
|
2
|
3
|
57.53
|
1
|
|
|
18-Deoxysagittarol
|
290.50
|
5.6
|
1
|
1
|
20.23
|
4
|
|
|
(3S)-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-1-en-3-ol
|
290.50
|
5.6
|
1
|
1
|
20.23
|
4
|
|
|
(E)-5-[(1R,2S,4aR,8aS)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoic acid
|
304.50
|
6.2
|
1
|
2
|
37.3
|
4
|
|
|
(E)-3-Methyl-5-((1R,4aR,8aR)-5,5,8a-trimethyl-2-methylenedecahydronaphthalen-1-yl)pent-2-enoic acid
|
304.50
|
6.3
|
1
|
2
|
37.3
|
4
|
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