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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Glechomafuran
|
248.32
|
2.3
|
0
|
3
|
38.2
|
0
|
|
|
Ibogamine
|
280.40
|
3.9
|
1
|
1
|
19.03
|
1
|
|
|
methyl (E)-2-[(2S,3Z,12bS)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate
|
366.50
|
2.7
|
1
|
4
|
54.56
|
4
|
|
|
N(6)-(dimethylallyl)adenosine 5'-monophosphate
|
415.34
|
-1.4
|
5
|
11
|
181.89
|
7
|
|
|
(2S,3R,3aS,6S,7aR)-2-(1,3-benzodioxol-5-yl)-3a,7a-dimethoxy-3-methyl-5-prop-2-enyl-2,3,6,7-tetrahydro-1-benzofuran-6-ol
|
374.40
|
2.1
|
1
|
6
|
66.38
|
5
|
|
|
angelol B
|
376.40
|
2.1
|
2
|
7
|
106.2
|
7
|
|
|
(7R)-7-Hydroxylariciresinol
|
376.40
|
1.3
|
4
|
7
|
108.61
|
6
|
|
|
[(1R,3R,4R,4aS,8aS)-4-hydroxy-3,4a,8,8-tetramethyl-4-[2-(5-oxo-2H-furan-4-yl)ethyl]-2,3,5,6,7,8a-hexahydro-1H-naphthalen-1-yl] acetate
|
378.50
|
4.2
|
1
|
5
|
72.83
|
5
|
|
|
Quercetin 7-O-sulfate
|
382.30
|
0.9
|
5
|
10
|
183.11
|
3
|
|
|
Uncinoside A
|
382.40
|
0.7
|
5
|
9
|
149.82
|
3
|
|
|
(6R,8S)-pentacosane-6,8-diol
|
384.70
|
10.5
|
2
|
2
|
40.46
|
22
|
|
|
Thalmidine
|
622.70
|
6.7
|
0
|
8
|
61.86
|
4
|
|
|
DL-Praeruptorin A
|
386.40
|
3.1
|
0
|
7
|
92.04
|
5
|
|
|
Obaberine
|
622.70
|
6.7
|
0
|
8
|
61.86
|
4
|
|
|
Corchoionoside A
|
388.50
|
-0.5
|
5
|
8
|
132.14
|
5
|
|
|
5,7-dihydroxy-4-[(1S)-1-hydroxypropyl]-8-(2-methylbutanoyl)-6-(3-methylbut-2-enyl)chromen-2-one
|
388.50
|
4.4
|
3
|
6
|
107.97
|
7
|
|
|
clauslactone C
|
392.40
|
0.8
|
3
|
9
|
135.66
|
4
|
|
|
US9328123, Rotenone
|
394.40
|
4.1
|
0
|
6
|
63.22
|
3
|
|
|
Xanthone V1a
|
396.40
|
5.9
|
4
|
6
|
111.13
|
4
|
|
|
(3Z,4R,5R)-4-hydroxy-5-methoxy-5-methyl-3-octadecylideneoxolan-2-one
|
396.60
|
8.6
|
1
|
4
|
55.76
|
17
|
|
|
Niaziminin
|
399.50
|
1.3
|
3
|
8
|
138.57
|
8
|
|
|
(-)-(7R,8S,7'E)-3,4,5,5'-tetramethoxy-4',7-epoxy-8,3'-neolign-7'-ene-9,9'-diol
|
402.40
|
2.2
|
2
|
7
|
86.61
|
8
|
|
|
Digitopurpone
|
270.24
|
3.3
|
3
|
5
|
94.83
|
0
|
|
|
[(3R,4R,5S)-5-(1,3-benzodioxol-5-yl)-4-(hydroxymethyl)oxolan-3-yl]-(3,4,5-trimethoxyphenyl)methanone
|
416.40
|
2
|
1
|
8
|
92.68
|
7
|
|
|
(5E)-4-methoxy-3-methyl-5-[(1S,2R,3S,6R,11S)-3-methyl-11-[(2S,4S)-4-methyl-5-oxooxolan-2-yl]-5-oxa-10-azatricyclo[8.3.0.02,6]tridecan-4-ylidene]furan-2-one
|
417.50
|
3
|
0
|
7
|
74.3
|
2
|
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