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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
1H-Pyrrolizin-1-ol, hexahydro-7-methylene-, (1R-trans)-
|
139.19
|
0.1
|
1
|
2
|
23.47
|
0
|
|
|
(1R,2S,6S,9S,10S,11S,14S,15S,17S,18S,20R,23R,24S)-6,10,23-Trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosane-10,17,20-triol
|
431.70
|
4.1
|
3
|
4
|
63.93
|
0
|
|
|
(1R,3E,7E,11R)-3,7,10,10-tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene
|
220.35
|
3.5
|
0
|
1
|
12.53
|
0
|
|
|
Tricyclohumuladiol
|
238.37
|
2.5
|
2
|
2
|
40.46
|
0
|
|
|
(1-Hydroxy-2,4,4-trimethylpentan-3-yl) 2-methylpropanoate
|
216.32
|
3.1
|
1
|
3
|
46.53
|
6
|
|
|
Lup-12-en-3-ol, (3beta,18beta,19beta)-
|
426.70
|
9
|
1
|
1
|
20.23
|
1
|
|
|
3-Methylcyclopentanone
|
98.14
|
0.8
|
0
|
1
|
17.07
|
0
|
|
|
7,8-Dihydroxy-6-methyl-4-(propan-2-yl)naphthalene-1,2-dione
|
246.26
|
2.4
|
2
|
4
|
74.6
|
1
|
|
|
nectandrin A
|
358.40
|
4.1
|
1
|
5
|
57.15
|
5
|
|
|
nectandrin-B
|
344.40
|
3.7
|
2
|
5
|
68.15
|
4
|
|
|
(E)-non-1-en-1-ol
|
142.24
|
4.4
|
1
|
1
|
20.23
|
6
|
|
|
7H-Furo(3,2-h)(2)benzopyran-3(2H)-one, 6,9-dihydro-7-hydroxy-7-methyl-2-(1-methylethylidene)-, (7R)-
|
260.28
|
2.3
|
1
|
4
|
55.76
|
0
|
|
|
2-Ethyl-p-xylene
|
134.22
|
3.4
|
0
|
0
|
0
|
1
|
|
|
4-Methyl-5-vinylthiazole
|
125.19
|
2.2
|
0
|
2
|
41.13
|
1
|
|
|
trans-1,3-Dimethylcyclopentane
|
98.19
|
3.2
|
0
|
0
|
0
|
0
|
|
|
Pokeberrygenin
|
516.70
|
5.2
|
3
|
6
|
104.06
|
3
|
|
|
Emeriphenolicin C
|
447.60
|
3.6
|
3
|
6
|
97.25
|
12
|
|
|
CID 156583056
|
671.90
|
6
|
5
|
7
|
171.8
|
11
|
|
|
5-[4-(1,3-Benzodioxol-5-yl)-2,3-dimethylbutyl]-2-methoxyphenol
|
328.40
|
5.2
|
1
|
4
|
47.92
|
6
|
|
|
SchisanlignaolD
|
400.40
|
3.9
|
1
|
7
|
75.61
|
2
|
|
|
(3S,4R,5S,6S,7R,16S,17R,18S,19S,20R)-4,5,6,17,18,19-hexahydroxy-13,26-dimethoxy-2,9,15,22,29,32-hexaoxapentacyclo[22.2.2.211,14.13,7.116,20]dotriaconta-1(26),11,13,24,27,30-hexaene-10,23-dione
|
624.50
|
-1
|
6
|
16
|
229.36
|
2
|
|
|
5-Isoquinolinol, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-((4-methoxy-3-(4-(((6S)-6,7,8,9-tetrahydro-4-methoxy-7-methyl-1,3-dioxolo(4,5-f)isoquinolin-6-yl)methyl)phenoxy)phenyl)methyl)-2-methyl-, (1S)-
|
668.80
|
6.5
|
1
|
10
|
91.32
|
10
|
|
|
Euphorbia factor L7b
|
580.70
|
4.6
|
0
|
9
|
122.27
|
10
|
|
|
Celosin J
|
1235.30
|
-1.6
|
15
|
28
|
446.96
|
13
|
|
|
5-[14-(3,5-Dihydroxyphenyl)tetradec-8-enyl]benzene-1,3-diol
|
412.60
|
8.3
|
4
|
4
|
80.92
|
14
|
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