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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
p-Coumaroyl hexose
|
655.10
|
18.1
|
0
|
2
|
26.3
|
22
|
|
|
Dulcisxanthone A
|
872.80
|
2.1
|
2
|
21
|
282.46
|
19
|
|
|
Sphaerobioside acetate
|
872.80
|
2.8
|
1
|
21
|
271.46
|
20
|
|
|
10,14-Dihydroxy-11-methoxy-3,3-dimethyl-12-(3-methyl-2-butenyl)-[1]benzopyrano[5,6-b]xanthen-13(3H)-one
|
458.50
|
6.9
|
2
|
6
|
89.13
|
3
|
|
|
9-F1-Phytoprostane
|
328.40
|
2.4
|
4
|
5
|
97.99
|
11
|
|
|
[(2S)-2-[[(Z)-docos-13-enoyl]amino]-3-hydroxydocosyl] 2-(trimethylazaniumyl)ethyl phosphate
|
843.30
|
17.3
|
2
|
6
|
117.73
|
46
|
|
|
Cryptoxanthin-alpha
|
552.90
|
12.3
|
1
|
1
|
20.23
|
10
|
|
|
E-10 devinylajoene
|
208.40
|
1.1
|
0
|
4
|
86.88
|
6
|
|
|
[(2S)-2-hexadecanoyloxy-3-tridecanoyloxypropyl] (7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoate
|
841.30
|
20.6
|
0
|
6
|
78.9
|
49
|
|
|
Farnesene-alpha
|
841.30
|
20.6
|
0
|
6
|
78.9
|
49
|
|
|
[(2S)-2-[(Z)-octadec-9-enoyl]oxy-3-tridecanoyloxypropyl] (8Z,11Z,14Z)-icosa-8,11,14-trienoate
|
841.30
|
20.3
|
0
|
6
|
78.9
|
49
|
|
|
[(E)-[6-methylsulfanyl-1-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylhexylidene]amino] sulfate
|
434.50
|
-0.2
|
4
|
12
|
227.92
|
10
|
|
|
[(E)-1-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylethylideneamino] sulfate
|
332.30
|
-1.9
|
4
|
11
|
202.62
|
4
|
|
|
[(2S)-2-heptadecanoyloxy-3-tetradecanoyloxypropyl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
|
841.30
|
20.6
|
0
|
6
|
78.9
|
49
|
|
|
[(2S)-1-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxy-3-tridecanoyloxypropan-2-yl] icosanoate
|
869.40
|
21.7
|
0
|
6
|
78.9
|
51
|
|
|
Limonin (17-beta-D-glucoside-)
|
869.40
|
21.4
|
0
|
6
|
78.9
|
51
|
|
|
[(2S)-3-hexadecanoyloxy-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropyl] nonadecanoate
|
869.40
|
21.7
|
0
|
6
|
78.9
|
51
|
|
|
Monotropein (6,7-dihydro-)
|
869.40
|
21.4
|
0
|
6
|
78.9
|
51
|
|
|
Noradrenaline (L-)
|
905.80
|
|
14
|
22
|
376.2
|
12
|
|
|
[(2S)-2-henicosanoyloxy-3-tridecanoyloxypropyl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
|
907.40
|
22.1
|
0
|
6
|
78.9
|
52
|
|
|
Sabinene-hydrate (trans)
|
907.40
|
22.1
|
0
|
6
|
78.9
|
52
|
|
|
Sinensal-alpha
|
612.60
|
|
9
|
15
|
245.29
|
6
|
|
|
Sitosterol-beta
|
907.40
|
21.7
|
0
|
6
|
78.9
|
52
|
|
|
Spinasterol-alpha
|
879.40
|
20.6
|
0
|
6
|
78.9
|
50
|
|
|
Sulforaphane-N-acetyl-L-cysteine
|
879.40
|
20.6
|
0
|
6
|
78.9
|
50
|
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