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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(1R,8R,9S,10S)-3,4,8-trihydroxy-11,11-dimethyl-5-propan-2-yltetracyclo[7.5.2.01,10.02,7]hexadeca-2,4,6-trien-15-one
|
344.40
|
3.5
|
3
|
4
|
77.76
|
1
|
|
|
(10R)-5,10-dihydroxy-4,6-dimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3,5,7(20),8,15,18-heptaen-12-one
|
370.40
|
2.7
|
2
|
6
|
85.22
|
2
|
|
|
(2R)-2-amino-5-[[hydroxy(sulfamoyloxy)phosphoryl]amino]pentanoic acid
|
291.22
|
-5.3
|
5
|
10
|
200.23
|
8
|
|
|
11-Dodecenoic acid
|
198.30
|
4.4
|
1
|
2
|
37.3
|
10
|
|
|
Phytolaccoside E
|
827.00
|
0.8
|
9
|
16
|
262.36
|
9
|
|
|
3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide
|
313.30
|
2.1
|
3
|
4
|
78.79
|
6
|
|
|
Phytane
|
282.50
|
9.9
|
0
|
0
|
0
|
13
|
|
|
Perforatic acid
|
302.28
|
2.2
|
1
|
6
|
85.97
|
2
|
|
|
Succinaldehyde
|
86.09
|
-0.9
|
0
|
2
|
34.14
|
3
|
|
|
5-[5-(Furan-3-yl)-2-methylpent-2-enyl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione
|
316.30
|
3.2
|
0
|
5
|
65.74
|
7
|
|
|
methyl (4aS,6aS,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
486.70
|
7.1
|
2
|
4
|
66.76
|
3
|
|
|
(2S)-hexadecan-2-ol
|
242.44
|
7.2
|
1
|
1
|
20.23
|
13
|
|
|
alpha-Campholenal
|
152.23
|
1.9
|
0
|
1
|
17.07
|
2
|
|
|
Pentyl formate
|
116.16
|
1.9
|
0
|
2
|
26.3
|
5
|
|
|
5,8-Dihydroxy-2-(2-(4-methoxyphenyl)ethyl)chromone
|
312.30
|
3.6
|
2
|
5
|
79.9
|
4
|
|
|
Selagine
|
242.32
|
0
|
2
|
2
|
58.88
|
0
|
|
|
Tridecanoic acid
|
214.34
|
4.7
|
1
|
2
|
37.3
|
11
|
|
|
Cyrtominetin
|
316.30
|
2.8
|
4
|
6
|
107.22
|
1
|
|
|
Tetradecyl acetate
|
256.42
|
6.7
|
0
|
2
|
26.3
|
14
|
|
|
Radermachol
|
368.40
|
5.4
|
1
|
4
|
67.51
|
1
|
|
|
Stearonitrile
|
265.50
|
8
|
0
|
1
|
23.79
|
15
|
|
|
Myricetin 7,3',4'-trimethyl ether
|
360.30
|
2.2
|
3
|
8
|
118.59
|
4
|
|
|
Octadecanal
|
268.50
|
8.1
|
0
|
1
|
17.07
|
16
|
|
|
Tricosane
|
324.60
|
12.1
|
0
|
0
|
0
|
20
|
|
|
Triacontane
|
422.80
|
15.8
|
0
|
0
|
0
|
27
|
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