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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(1S,2R,4S,5R,10S,12S,14R,15R,18R)-5-[(1R)-1-hydroxyethyl]-10,15-dimethyl-3,6,13,17-tetraoxahexacyclo[8.7.1.02,4.04,9.012,14.015,18]octadec-8-ene-7,16-dione
|
348.30
|
-0.3
|
1
|
7
|
97.89
|
1
|
|
|
(1R,2R,4R,5S,8S,9R,10S,13S,16R)-2,8,16-trihydroxy-5-(hydroxymethyl)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-15-one
|
350.40
|
0.8
|
4
|
5
|
97.99
|
1
|
|
|
Stemmadenine
|
354.40
|
1.8
|
2
|
4
|
65.56
|
3
|
|
|
1,3,6-Trihydroxy-5-methoxy-10-methyl-4-(3-methylbut-2-enyl)acridin-9-one
|
355.40
|
4.5
|
3
|
6
|
91.92
|
3
|
|
|
clauslactone A
|
358.30
|
2.2
|
1
|
7
|
95.2
|
3
|
|
|
2-(3-Methoxy-4-hydroxyphenyl)-5-(3,4-dimethoxyphenyl)-3,4-dimethyltetrahydrofuran
|
358.40
|
4.1
|
1
|
5
|
57.15
|
5
|
|
|
(1S,7S)-7-hydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carbaldehyde
|
360.36
|
-2
|
5
|
9
|
145.91
|
4
|
|
|
6alpha-Hydroxyeurycomalactone
|
364.40
|
-0.5
|
3
|
7
|
121.13
|
0
|
|
|
6-((8Z,11Z,14Z)-heptadeca-8,11,14-trien-1-yl)salicylic acid
|
370.50
|
8.3
|
2
|
3
|
57.53
|
14
|
|
|
2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(3,4-methylenedioxyphenyl)-1-propanol
|
372.40
|
4
|
1
|
6
|
66.38
|
8
|
|
|
(5S,6R)-7,9-dibromo-6-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,7,9-triene-3-carboxamide
|
382.01
|
-0.2
|
2
|
5
|
94.14
|
2
|
|
|
Niazicin A
|
385.40
|
1
|
3
|
8
|
138.57
|
7
|
|
|
Euglobal G1
|
386.50
|
5.2
|
2
|
5
|
83.83
|
4
|
|
|
5-[(3S,10R,13R,14S,17R)-14-hydroxy-10,13-dimethyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one
|
530.60
|
1.9
|
4
|
8
|
129.59
|
3
|
|
|
Stipulin
|
392.50
|
7
|
3
|
4
|
77.76
|
7
|
|
|
Auda
|
392.60
|
5.9
|
3
|
3
|
78.43
|
13
|
|
|
(3E,4R,5R)-4-hydroxy-5-methoxy-5-methyl-3-octadecylideneoxolan-2-one
|
396.60
|
8.6
|
1
|
4
|
55.76
|
17
|
|
|
2-[3-[4-[4-(Diaminomethylideneamino)butyl]-6,7-dimethoxyisoquinolin-1-yl]propyl]guanidine
|
401.50
|
0.6
|
4
|
5
|
160.15
|
11
|
|
|
(3R,4R)-3-[(4-hydroxy-3-methoxyphenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one
|
402.40
|
3.6
|
1
|
7
|
83.45
|
8
|
|
|
(2R,4S,5R,10S,12S,14R,15R,18R)-5-[(2R)-2-hydroxy-1-methylsulfinylpropan-2-yl]-10,15-dimethyl-3,6,13,17-tetraoxahexacyclo[8.7.1.02,4.04,9.012,14.015,18]octadec-8-ene-7,16-dione
|
424.50
|
-1.4
|
1
|
9
|
134.17
|
3
|
|
|
Isopanduratin A
|
406.50
|
6
|
2
|
4
|
66.76
|
6
|
|
|
3'-Geranylchalconaringenin
|
408.50
|
6.6
|
4
|
5
|
97.99
|
8
|
|
|
2,3,5-trimethoxy-6-[(3S)-6,7,8-trimethoxy-3,4-dihydro-2H-chromen-3-yl]cyclohexa-2,5-diene-1,4-dione
|
420.40
|
2.3
|
0
|
9
|
98.75
|
7
|
|
|
7-Hydroxy-3-(4-hydroxyphenyl)-5-methoxy-6,8-bis(3-methylbut-2-enyl)chromen-4-one
|
420.50
|
6.3
|
2
|
5
|
79.9
|
6
|
|
|
Isonymphaeol B
|
424.50
|
5.8
|
4
|
6
|
107.22
|
6
|
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