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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Angelol G
|
376.40
|
2.1
|
2
|
7
|
106.2
|
7
|
|
|
brasixanthone B
|
378.40
|
5.7
|
2
|
5
|
79.9
|
2
|
|
|
Yuanamide
|
381.40
|
3
|
0
|
5
|
58.92
|
4
|
|
|
3,3',4,5'-Tetrahydroxy-4',5-diprenylbibenzyl
|
382.50
|
6.6
|
4
|
4
|
80.92
|
7
|
|
|
[(3S,3aR,4R,5S,6R,8aR)-3,4-dihydroxy-3-methyl-8-methylidene-5-propan-2-yl-1,2,3a,4,5,6,7,8a-octahydroazulen-6-yl] (E)-3-phenylprop-2-enoate
|
384.50
|
4.1
|
2
|
4
|
66.76
|
5
|
|
|
Erycristagallin
|
390.50
|
6.7
|
2
|
4
|
62.83
|
4
|
|
|
2-Cyclohexen-1-one, 6-methyl-3-(1-methylethyl)-
|
152.23
|
2.1
|
0
|
1
|
17.07
|
1
|
|
|
5-(2'-Oxononadecyl)-resorcinol
|
390.60
|
9.2
|
2
|
3
|
57.53
|
18
|
|
|
[(7S,8R)-7-[(Z)-2-methylbut-2-enoyl]oxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2S)-2,3-dihydroxy-2-(1-hydroxyethyl)-3-methylbutanoate
|
397.50
|
-0.1
|
3
|
8
|
116.53
|
9
|
|
|
5,7-Dihydroxy-6-methyl-4-phenyl-8-(3-phenylpropionyl)-1-benzopyran-2-one
|
400.40
|
4.9
|
2
|
5
|
87.74
|
5
|
|
|
Mundulinol
|
406.50
|
5.4
|
2
|
5
|
75.99
|
3
|
|
|
Carvacrol
|
150.22
|
3.1
|
1
|
1
|
20.23
|
1
|
|
|
S-(4-Hydroxybenzyl)glutathione
|
413.40
|
-3
|
6
|
9
|
204.35
|
12
|
|
|
Forticine
|
415.70
|
5.5
|
2
|
3
|
43.7
|
0
|
|
|
Bismurrayaquinone A
|
420.40
|
4.3
|
2
|
4
|
99.86
|
1
|
|
|
2-Methylbutyl benzoate
|
192.25
|
4
|
0
|
2
|
26.3
|
5
|
|
|
5-[(3S,3aR,6R,6aR)-6-methoxy-6-(3,4,5-trimethoxyphenyl)-3,3a,4,6a-tetrahydro-1H-furo[3,4-c]furan-3-yl]-1,3-benzodioxole
|
430.40
|
2.5
|
0
|
8
|
73.84
|
6
|
|
|
(1R,2S,4S,5'R,6R,7S,8R,9S,10R,12S,13S,18S)-10-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-one
|
430.60
|
4.7
|
1
|
4
|
55.76
|
0
|
|
|
(2S,4S,5'R,6R,7S,8R,9S,10R,12S,13S,16S,18S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-10,16-diol
|
432.60
|
5.1
|
2
|
4
|
58.92
|
0
|
|
|
Ugonin k
|
436.50
|
5.7
|
3
|
6
|
100.13
|
4
|
|
|
ugonin L
|
436.50
|
5.2
|
2
|
6
|
89.13
|
2
|
|
|
(3S,4aR,6aS,6bS,8aR,12aR,14bS)-3-hydroxy-4,4,6a,6b,8a,11,11,14b-octamethyl-2,3,4a,5,7,8,9,10,12,12a,13,14-dodecahydro-1H-picen-6-one
|
440.70
|
7.9
|
1
|
2
|
37.3
|
0
|
|
|
3-[(3S,4S,8S,9R,10S,13R,14R,17R)-4,8,9,13-tetramethyl-17-propan-2-yl-3-prop-1-en-2-yl-2,3,7,10,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-4-yl]propanoic acid
|
440.70
|
9.1
|
1
|
2
|
37.3
|
5
|
|
|
Rhinacanthin E
|
442.40
|
3.6
|
0
|
9
|
98.75
|
9
|
|
|
7-hydroxy-3-(4-methoxyphenyl)-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
446.40
|
0.6
|
5
|
10
|
159.05
|
5
|
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