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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
boeravinone D
|
342.30
|
2.6
|
3
|
7
|
109.36
|
1
|
|
|
[(7R,8R)-7-(2-methylbut-2-enoyloxy)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2S)-2-hydroxy-2-[(1S)-1-hydroxyethyl]-3-methylbutanoate
|
381.50
|
1.3
|
2
|
7
|
96.3
|
9
|
|
|
5-Hydroxy-3-[5-hydroxy-2,2-dimethyl-7,10-bis(2-methylbut-3-en-2-yl)-8-oxopyrano[3,2-g]chromen-3-yl]-2,2-dimethyl-7,10-bis(2-methylbut-3-en-2-yl)pyrano[3,2-g]chromen-8-one
|
758.90
|
11.6
|
2
|
8
|
119.34
|
9
|
|
|
Trideca-3,5,7,9,11-pentayne-1,2-diol
|
196.20
|
1.1
|
2
|
2
|
40.46
|
5
|
|
|
[(4E,6E,10E,12E)-tetradeca-4,6,10,12-tetraen-8-ynyl] acetate
|
244.33
|
4.1
|
0
|
2
|
26.3
|
7
|
|
|
4,7-Dihydroxy-2,3-methylenedioxy-9,10-dihydro-phenanthrene
|
256.25
|
2.9
|
2
|
4
|
58.92
|
0
|
|
|
3,2'-Dihydroxy-5'-methoxy-4,5-methylene-dioxybibenzyl
|
288.29
|
3.2
|
2
|
5
|
68.15
|
4
|
|
|
Ethylsuberenol
|
288.34
|
3.1
|
0
|
4
|
48.67
|
5
|
|
|
(4R,4aS,6aS,6aS,6bR,8aR,12aR,14aS,14bS)-4,4a,6a,6b,8a,11,11,14a-octamethyl-1,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydropicene-2,3-dione
|
440.70
|
9
|
0
|
2
|
34.14
|
0
|
|
|
Barpisoflavone C
|
366.40
|
3.4
|
2
|
6
|
89.13
|
2
|
|
|
(2E)-8-hydroxy-2-(8-hydroxy-4-methoxy-6-methyl-1-oxonaphthalen-2-ylidene)-4-methoxy-6-methylnaphthalen-1-one
|
404.40
|
4.9
|
2
|
6
|
93.06
|
2
|
|
|
Allophanic acid
|
104.07
|
-0.1
|
3
|
3
|
92.42
|
0
|
|
|
Imidazole-4-acetaldehyde
|
110.11
|
-0.5
|
1
|
2
|
45.75
|
2
|
|
|
Deoxycytidine diphosphate
|
387.18
|
-4.5
|
5
|
10
|
223.28
|
6
|
|
|
Tetradecylbenzene
|
274.50
|
9.9
|
0
|
0
|
0
|
13
|
|
|
E-Caffeic acid pentyl ester
|
250.29
|
4.1
|
2
|
4
|
66.76
|
7
|
|
|
Cannabisin A
|
594.60
|
5.1
|
8
|
8
|
179.58
|
9
|
|
|
[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] dodecanoate
|
597.00
|
15.1
|
0
|
2
|
26.3
|
18
|
|
|
2-hydroxy-N-[(7S)-2-hydroxy-1,3,10-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
|
401.40
|
-0.2
|
3
|
7
|
114.32
|
5
|
|
|
N-Methylserotonin
|
190.24
|
0.7
|
3
|
2
|
48.05
|
3
|
|
|
Hv-NCC-1
|
678.70
|
0.6
|
8
|
10
|
234.9
|
15
|
|
|
(S)-Columbianetin
|
246.26
|
1.9
|
1
|
4
|
59.67
|
1
|
|
|
Orthonitrophenyl-beta-D-fucopyranoside
|
285.25
|
-0.7
|
3
|
7
|
122.29
|
2
|
|
|
1,3,5-Tri-tert-butylbenzene
|
246.40
|
6.9
|
0
|
0
|
0
|
3
|
|
|
Stizolicin
|
378.40
|
0.6
|
2
|
7
|
105.59
|
5
|
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