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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
1-Methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol
|
267.32
|
2.6
|
2
|
3
|
41.49
|
1
|
|
|
3-[(3S,5R,8R,9S,10S,13R,14S,17R)-14-hydroxy-3-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-dimethoxyoxan-2-yl]oxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
|
564.70
|
2.1
|
3
|
9
|
123.91
|
6
|
|
|
3-[(2S,3R,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
|
434.30
|
1
|
7
|
11
|
190.28
|
4
|
|
|
Azadiradione
|
450.60
|
4.8
|
0
|
5
|
73.58
|
3
|
|
|
17-Epiazadiradione
|
450.60
|
4.8
|
0
|
5
|
73.58
|
3
|
|
|
(13alpha,17alpha)-7alpha-Acetoxy-21,23-epoxy-4,4,8-trimethyl-24-nor-5alpha-chola-1,14,20,22-tetren-3-one
|
436.60
|
5.7
|
0
|
4
|
56.51
|
3
|
|
|
2-(3,4-Dihydroxyphenyl)-7-hydroxy-5-methoxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-4-one
|
462.40
|
0.6
|
6
|
11
|
179.28
|
4
|
|
|
(-)-Bilobalide from ginkgo leaves
|
326.30
|
-0.3
|
2
|
8
|
119.36
|
1
|
|
|
(S)-Bilobanone
|
232.32
|
3.4
|
0
|
2
|
30.21
|
3
|
|
|
Bipindogenin
|
406.50
|
1.6
|
4
|
6
|
107.22
|
1
|
|
|
(1S,2R,5S,7S)-2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undec-8-en-4-one
|
218.33
|
3
|
0
|
1
|
17.07
|
0
|
|
|
(1S,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.3.1.01,5]undecan-4-one
|
218.33
|
3.2
|
0
|
1
|
17.07
|
0
|
|
|
2-[2-(6-methoxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl)propyl]-4-methyl-2H-furan-5-one
|
468.70
|
8.6
|
0
|
3
|
35.53
|
4
|
|
|
1-Phenyl-1-butene
|
132.20
|
3.6
|
0
|
0
|
0
|
2
|
|
|
CID 12308806
|
385.60
|
4.7
|
1
|
3
|
40.54
|
2
|
|
|
6-(Dimethylamino)-15-[1-(dimethylamino)ethyl]-7-(hydroxymethyl)-7,12,16-trimethylpentacyclo[9.7.0.01,3.03,8.012,16]octadec-9-en-14-ol
|
444.70
|
4.5
|
2
|
4
|
46.94
|
4
|
|
|
Cycloprotobuxin-D
|
386.70
|
6.6
|
2
|
2
|
24.06
|
3
|
|
|
(-)-Cyperene
|
204.35
|
4.3
|
0
|
0
|
0
|
0
|
|
|
(-)-delta-Selinene
|
204.35
|
4.3
|
0
|
0
|
0
|
1
|
|
|
(+)-delta-Selinene
|
204.35
|
4.3
|
0
|
0
|
0
|
1
|
|
|
Cyperenol
|
220.35
|
3.1
|
1
|
1
|
20.23
|
1
|
|
|
(1aR,3aR,4R,7R,8aS)-1a,4,9,9-Tetramethyloctahydro-3a,7-methanoazuleno[1,8a-b]oxirene
|
220.35
|
3.8
|
0
|
1
|
12.53
|
0
|
|
|
Methyl 7-ethyl-5-methyl-10-oxo-5,12-diazatetracyclo[9.7.0.03,8.013,18]octadeca-1(11),13,15,17-tetraene-3-carboxylate
|
354.40
|
3
|
1
|
4
|
62.4
|
3
|
|
|
20-epi-Evatamine
|
354.40
|
3
|
1
|
4
|
62.4
|
3
|
|
|
Erysimoside
|
696.80
|
-1.3
|
7
|
14
|
221.9
|
7
|
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