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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
2-Amino-1-phenylethanol
|
137.18
|
0.1
|
2
|
2
|
46.25
|
2
|
|
|
(-)-Cornigerine
|
383.40
|
0.7
|
1
|
6
|
83.09
|
3
|
|
|
Dauricumidine
|
383.80
|
-0.8
|
2
|
7
|
94.09
|
3
|
|
|
1,2,4-Trimethoxy-5-[2-(2,4,5-trimethoxyphenyl)cyclobutyl]benzene
|
388.50
|
4.4
|
0
|
6
|
55.38
|
8
|
|
|
Dihydrocondylocarpine
|
324.40
|
3.1
|
1
|
4
|
41.57
|
3
|
|
|
N-Benzoyl-L-phenylalaninol
|
255.31
|
2.5
|
2
|
2
|
49.33
|
5
|
|
|
6,7-dimethoxy-4-(6-methoxy-1,3-benzodioxol-5-yl)-3H-benzo[f][2]benzofuran-1-one
|
394.40
|
4
|
0
|
7
|
72.45
|
4
|
|
|
1,3,5,6-Tetrahydroxy-4-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)xanthen-9-one
|
396.40
|
5.8
|
4
|
6
|
111.13
|
5
|
|
|
Interruptin B
|
398.40
|
5.1
|
2
|
5
|
87.74
|
4
|
|
|
Graminone B
|
402.40
|
2
|
2
|
8
|
103.68
|
5
|
|
|
methyl 3-[(1R,6R,10R,13R,14S,17S)-16-formyl-10-(hydroxymethyl)-14-methyl-9-oxo-16-azatetracyclo[8.7.0.02,6.013,17]heptadec-2-en-1-yl]propanoate
|
403.50
|
1.9
|
1
|
5
|
83.91
|
5
|
|
|
Lupalbigenin
|
406.50
|
6.5
|
3
|
5
|
90.9
|
5
|
|
|
Manglexanthone
|
408.40
|
5.6
|
2
|
6
|
89.13
|
3
|
|
|
Bidwillon A
|
408.50
|
5.9
|
3
|
5
|
86.99
|
5
|
|
|
5-[(E)-3-hydroxy-3-methylbut-1-enyl]-6-propan-2-yl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohepta-2,4,6-trien-1-one
|
410.50
|
0.2
|
5
|
8
|
136.68
|
6
|
|
|
Kanzonol Y
|
410.50
|
6.3
|
4
|
5
|
97.99
|
8
|
|
|
(3R,3aR,5aR,7aS,11bS,13aS)-3a,5a,7a,8,11b,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,7,10,11,11a,12,13,13b-tetradecahydrocyclopenta[a]chrysene
|
410.70
|
10.6
|
0
|
0
|
0
|
1
|
|
|
Methyl 2-[6-(furan-3-yl)-7,9,11,15-tetramethyl-12,16-dioxo-3,17-dioxapentacyclo[9.6.1.02,9.04,8.015,18]octadeca-7,13-dien-10-yl]acetate
|
466.50
|
2.2
|
0
|
7
|
92.04
|
4
|
|
|
(1S,3R,6S,8R,11S,12S,15S,16R)-15-[(1S)-1-(dimethylamino)ethyl]-N,N,7,7,12,16-hexamethylpentacyclo[9.7.0.01,3.03,8.012,16]octadec-9-en-6-amine
|
412.70
|
6.9
|
0
|
2
|
6.48
|
3
|
|
|
2-[2-[[17-[2-[6-[[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-methylhept-5-en-2-yl]-12-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
1079.30
|
0.9
|
14
|
22
|
357.06
|
16
|
|
|
2,9,10-Trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4h-dibenzo[de,g]quinolin-1-ol
|
341.40
|
2.6
|
1
|
5
|
51.16
|
3
|
|
|
[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)oxan-2-yl]methyl (Z)-3-(4-hydroxyphenyl)prop-2-enoate
|
418.40
|
1.5
|
5
|
9
|
145.91
|
7
|
|
|
Diosbulbin D
|
344.40
|
1.4
|
0
|
6
|
82.81
|
1
|
|
|
(2S,3aR,4S,4'S,5'R,6S,7aR)-4'-benzoyloxy-3a,4-dihydroxy-5'-methyl-3-oxospiro[5,6,7,7a-tetrahydro-4H-1-benzofuran-2,2'-oxane]-6-carboxylic acid
|
420.40
|
0.7
|
3
|
9
|
139.59
|
4
|
|
|
(9-Acetyloxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl) 4-hydroxy-2-(hydroxymethyl)but-2-enoate
|
420.50
|
0.6
|
2
|
8
|
119.36
|
7
|
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