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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Macelignan
|
328.40
|
5.2
|
1
|
4
|
47.92
|
6
|
|
|
Prudomestin
|
330.29
|
2.8
|
3
|
7
|
109.36
|
3
|
|
|
cephalotaxine beta-N-oxide
|
331.40
|
0.9
|
1
|
5
|
70.98
|
1
|
|
|
Dulciol D
|
336.30
|
5.2
|
2
|
5
|
83.81
|
2
|
|
|
Qywqqlpgazoyal-wiyylymnsa-
|
338.40
|
2.8
|
1
|
3
|
47.28
|
3
|
|
|
5-Nonanone
|
142.24
|
2.7
|
0
|
1
|
17.07
|
6
|
|
|
O-Methylpallidine
|
341.40
|
2.3
|
0
|
5
|
48
|
3
|
|
|
Dulxanthone D
|
342.30
|
4.3
|
3
|
6
|
100.13
|
3
|
|
|
Ehretianone
|
350.40
|
3.4
|
1
|
4
|
63.6
|
2
|
|
|
(2S,10S)-6-methoxy-19,19-dimethyl-3,12,20-trioxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),4(9),5,7,14,16(21)-hexaen-15-ol
|
354.40
|
3.6
|
1
|
5
|
57.15
|
1
|
|
|
Butyrolactone II
|
356.30
|
2.4
|
3
|
7
|
113.29
|
5
|
|
|
Dihydrolicoisoflavone
|
356.40
|
4.1
|
4
|
6
|
107.22
|
3
|
|
|
(3R,5R,8S,11S,12S)-5-(furan-3-yl)-12-hydroxy-3,11-dimethyl-6,14-dioxatetracyclo[10.2.2.02,11.03,8]hexadec-15-ene-7,13-dione
|
358.40
|
2.2
|
1
|
6
|
85.97
|
1
|
|
|
[(4S,4aR,6S,7R,7aS)-2,4,7-trimethyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridin-6-yl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
|
359.50
|
3.9
|
1
|
5
|
59
|
5
|
|
|
3-O-acetylpadmatin
|
360.30
|
2.4
|
3
|
8
|
122.52
|
4
|
|
|
4-[[(5S)-5-(4-hydroxy-3-methoxyphenyl)-4-(hydroxymethyl)oxolan-3-yl]methyl]-2-methoxyphenol
|
360.40
|
2.4
|
3
|
6
|
88.38
|
6
|
|
|
(2S)-1-[[(3R,3aS,5aR,6R,9aS,9bS)-6-hydroxy-5a-methyl-9-methylidene-2-oxo-3a,4,5,6,7,8,9a,9b-octahydro-3H-benzo[g][1]benzofuran-3-yl]methyl]pyrrolidine-2-carboxylic acid
|
363.40
|
-0.5
|
2
|
6
|
87.07
|
3
|
|
|
methyl (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(5-hydroxy-4-oxochromen-7-yl)oxyoxane-2-carboxylate
|
368.29
|
0.2
|
4
|
10
|
155.89
|
4
|
|
|
2-[(9Z,12Z)-heptadeca-9,12-dienyl]-6-hydroxybenzoic acid
|
372.50
|
8.9
|
2
|
3
|
57.53
|
15
|
|
|
(E)-beta-farnesene
|
204.35
|
6.2
|
0
|
0
|
0
|
7
|
|
|
clauslactone B
|
376.40
|
1.3
|
2
|
8
|
115.43
|
3
|
|
|
Anastatin B
|
378.30
|
3.8
|
4
|
7
|
120.36
|
1
|
|
|
8,11-Dihydroxy-2,2-dimethyl-9-(2-methylbut-3-en-2-yl)pyrano[3,2-c]xanthen-7-one
|
378.40
|
5.7
|
2
|
5
|
79.9
|
2
|
|
|
Julandine
|
379.50
|
4.1
|
0
|
4
|
30.93
|
5
|
|
|
[(5R,5As,9aS,9bS)-9b-hydroxy-6,6,9a-trimethyl-1-oxo-3,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-5-yl] (2E,4E,6E)-octa-2,4,6-trienoate
|
386.50
|
4.2
|
1
|
5
|
72.83
|
5
|
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