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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Clausenidinaric acid
|
346.40
|
3.7
|
3
|
6
|
104.06
|
4
|
|
|
Hemistepsin
|
346.40
|
0.6
|
2
|
6
|
93.06
|
4
|
|
|
[(4S,4aS,5R,6S,8aR,9aR)-6-hydroxy-3,4a,5-trimethyl-2-oxo-4,5,6,7,8,8a,9,9a-octahydrobenzo[f][1]benzofuran-4-yl] (E)-2-methylbut-2-enoate
|
348.40
|
2.8
|
1
|
5
|
72.83
|
3
|
|
|
6-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-7-methoxy-3H-benzo[f][1]benzofuran-2-one
|
352.30
|
3.5
|
2
|
6
|
85.22
|
3
|
|
|
methyl (Z)-2-[(3E)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-hydroxyprop-2-enoate
|
352.40
|
3
|
2
|
4
|
65.56
|
3
|
|
|
Cnidicin
|
354.40
|
5.3
|
0
|
5
|
61.81
|
6
|
|
|
Terphenyllin
|
338.40
|
4.1
|
3
|
5
|
79.15
|
4
|
|
|
3-Methylbutyl 6-methoxy-2,2-dimethylbenzo[h]chromene-5-carboxylate
|
354.40
|
5.6
|
0
|
4
|
44.76
|
6
|
|
|
(2S,3R,4S,5S,6R)-2-[2-hydroxy-4-[(E)-3-hydroxyprop-1-enyl]-6-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
358.34
|
-1.6
|
6
|
9
|
149.07
|
6
|
|
|
CID 10044294
|
364.34
|
-3.3
|
7
|
10
|
169.3
|
3
|
|
|
Deacetylforskolin
|
368.50
|
0.4
|
4
|
6
|
107.22
|
1
|
|
|
Methyl (6aS)-4,5,6a,7-tetrahydro-1,2,10-trimethoxy-6H-dibenzo[de,g]quinoline-6-carboxylate
|
369.40
|
3.3
|
0
|
5
|
57.23
|
4
|
|
|
(-)-3,4-Dimethoxy-3,4-desmethylenedioxycubebin
|
372.40
|
3.5
|
1
|
6
|
66.38
|
6
|
|
|
Thiophene A
|
196.27
|
4
|
0
|
1
|
28.24
|
3
|
|
|
(2R,3R,4S,5R)-2-(6-((3-Hydroxybenzyl)amino)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
|
373.40
|
0.8
|
5
|
9
|
145.78
|
5
|
|
|
3-Hydroxy-4,5-bis(hydroxymethyl)-2-(3-methylbut-2-en-1-yl)phenyl 2,4-dihydroxy-6-methylbenzoate
|
388.40
|
3.9
|
5
|
7
|
127.45
|
7
|
|
|
Tetradec-6-en-8,10,12-triyn-3-one
|
198.26
|
2.9
|
0
|
1
|
17.07
|
6
|
|
|
vaccihein A
|
378.30
|
2
|
3
|
9
|
131.75
|
8
|
|
|
Echitamine chloride
|
385.50
|
0.7
|
3
|
5
|
78.79
|
3
|
|
|
(3R,4R)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]oxolan-2-one
|
386.40
|
3.4
|
1
|
7
|
83.45
|
6
|
|
|
5,8,9-Trihydroxy-2,2-dimethyl-10-(3-methylbut-2-enyl)pyrano[3,2-b]xanthen-6-one
|
394.40
|
5.3
|
3
|
6
|
100.13
|
2
|
|
|
Kanzonol X
|
394.50
|
6.5
|
3
|
4
|
69.92
|
5
|
|
|
5-[(E)-2-(2,4-dihydroxyphenyl)ethenyl]-2-[(E)-7-hydroxy-3,7-dimethyloct-2-enyl]benzene-1,3-diol
|
398.50
|
5.2
|
5
|
5
|
101.15
|
8
|
|
|
Prevezol C
|
401.40
|
4.1
|
3
|
3
|
60.69
|
4
|
|
|
(1S,2S,3R,6S,7S,9R,13R,17S)-3,4,15-trimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-11,16-dione
|
404.50
|
2.4
|
0
|
6
|
71.06
|
3
|
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