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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,3Z,5S)-5-ethyl-6-methylhepta-3,6-dien-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
410.70
|
8.7
|
1
|
1
|
20.23
|
5
|
|
|
22-Dehydroclerosterol
|
410.70
|
8.7
|
1
|
1
|
20.23
|
5
|
|
|
Methyl heptadecanoate
|
284.50
|
8.5
|
0
|
2
|
26.3
|
16
|
|
|
Securinegine
|
217.26
|
1.4
|
0
|
3
|
29.54
|
0
|
|
|
Deoxyartemsinin
|
266.33
|
2.4
|
1
|
4
|
55.76
|
0
|
|
|
5,18-Dihydroxy-1,14,21,25-tetramethyl-4,20,23-trioxaheptacyclo[20.3.1.12,5.03,18.03,21.06,15.09,14]heptacosa-8,10-diene-13,19,24,27-tetrone
|
512.50
|
1
|
2
|
9
|
136.43
|
0
|
|
|
6-[4,5-Dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychromen-4-one
|
592.50
|
-0.6
|
8
|
14
|
228.97
|
6
|
|
|
2,4,6-trihydroxy-3-methyl-5-[(3S)-3-methylpentanoyl]benzaldehyde
|
266.29
|
3.3
|
3
|
5
|
94.83
|
5
|
|
|
2,4-Undecadiene-8,10-diynoic acid isobutylamide
|
229.32
|
3.2
|
1
|
1
|
29.1
|
7
|
|
|
(2Z,4E)-N-(2-methylpropyl)undeca-2,4-dien-8,10-diynamide
|
229.32
|
3.2
|
1
|
1
|
29.1
|
7
|
|
|
(2E,4E)-N-(2-methylpropyl)dodeca-2,4-dien-8,10-diynamide
|
243.34
|
3.7
|
1
|
1
|
29.1
|
7
|
|
|
(2E,4E,10E)-N-(2-methylpropyl)dodeca-2,4,10-trien-8-ynamide
|
245.36
|
4
|
1
|
1
|
29.1
|
6
|
|
|
(2E,4Z,10Z)-N-(2-methylpropyl)dodeca-2,4,10-trien-8-ynamide
|
245.36
|
4
|
1
|
1
|
29.1
|
6
|
|
|
dodeca-2E,4E,8Z-trienoic acid isobutylamide
|
249.39
|
4.5
|
1
|
1
|
29.1
|
9
|
|
|
(2E,7Z)-N-Isobutyl-2,7-tridecadiene-10,12-diynamide
|
257.37
|
4
|
1
|
1
|
29.1
|
9
|
|
|
(2E,4Z)-N-(2-methylbutyl)undeca-2,4-dien-8,10-diynamide
|
243.34
|
3.6
|
1
|
1
|
29.1
|
8
|
|
|
(2E,4Z)-N-(2-methylbutyl)dodeca-2,4-dien-8,10-diynamide
|
257.37
|
4.1
|
1
|
1
|
29.1
|
8
|
|
|
[(1R,2R,3R)-2-methyl-3-[(1E,5E,9E)-2,6,10,14-tetramethylpentadeca-1,5,9,13-tetraenyl]-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]cyclopropyl]methanol
|
562.90
|
13.8
|
1
|
1
|
20.23
|
20
|
|
|
5,6,7-Trimethoxy-8-(3-methyl-2-oxobutyl)chromen-2-one
|
320.30
|
2.5
|
0
|
6
|
74.97
|
6
|
|
|
3-(5,7-Dimethoxy-2-oxochromen-8-yl)-2,2-dimethylpropanoic acid
|
306.31
|
2.5
|
1
|
6
|
85.97
|
5
|
|
|
3-(5,7-Dimethoxy-2-oxochromen-8-yl)-2,2-dimethylpropanal
|
290.31
|
2.5
|
0
|
5
|
65.74
|
5
|
|
|
Methyl nonadecanoate
|
312.50
|
9.5
|
0
|
2
|
26.3
|
18
|
|
|
Dimethyl suberate
|
202.25
|
1.9
|
0
|
4
|
52.6
|
9
|
|
|
3H-Naphtho(1,8-bc)furan-3,8(4H)-dione, 5,5a,6,7-tetrahydro-7-methyl-5-(1-methylethyl)-, (5R,5aR,7S)-
|
246.30
|
2.9
|
0
|
3
|
47.28
|
1
|
|
|
Dimethyl azelate
|
216.27
|
2.5
|
0
|
4
|
52.6
|
10
|
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