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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
6-[6-Carboxy-2-[(2,5,6,10,10,14,21-heptamethyl-16,22-dioxo-23-oxahexacyclo[19.2.1.02,19.05,18.06,15.09,14]tetracos-17-en-11-yl)oxy]-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
|
820.90
|
3.2
|
7
|
16
|
256.04
|
6
|
|
|
(1R,2R,5S,6R,9S,11S,14S,15R,19S,21R)-11-hydroxy-2,5,6,10,10,14,21-heptamethyl-23-oxahexacyclo[19.2.1.02,19.05,18.06,15.09,14]tetracos-17-ene-16,22-dione
|
468.70
|
5.9
|
1
|
4
|
63.6
|
0
|
|
|
(3S,4S,5S,9S,10S,13R,14R,17R)-4,10,13-trimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
412.70
|
8.8
|
1
|
1
|
20.23
|
5
|
|
|
Isoglycycoumarin
|
368.40
|
3.8
|
2
|
6
|
89.13
|
2
|
|
|
Neoisoliquritin
|
418.40
|
1.7
|
6
|
9
|
156.91
|
6
|
|
|
Amoricin
|
504.60
|
7.5
|
2
|
6
|
85.22
|
6
|
|
|
Amoridin
|
490.60
|
7.2
|
3
|
6
|
96.22
|
5
|
|
|
2-[3,4-Dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5-hydroxy-8,8-dimethyl-6-(3-methylbut-2-enyl)-2,3-dihydropyrano[2,3-h]chromen-4-one
|
490.60
|
7.2
|
3
|
6
|
96.22
|
5
|
|
|
(E)-N-(2-methylpropyl)oct-2-enamide
|
197.32
|
3.8
|
1
|
1
|
29.1
|
7
|
|
|
Mallotus A
|
338.40
|
4.1
|
3
|
5
|
86.99
|
3
|
|
|
2',4'-Dihydroxy-6'-methoxy-3'-prenylchalcone
|
338.40
|
5.4
|
2
|
4
|
66.76
|
6
|
|
|
Mallotus B
|
518.60
|
6.1
|
5
|
8
|
144.52
|
6
|
|
|
1,5-Dihydroxy-7-methoxyfluoren-9-one
|
242.23
|
2.9
|
2
|
4
|
66.76
|
1
|
|
|
1,2,5-Trihydroxy-7-methoxyfluoren-9-one
|
258.23
|
2.5
|
3
|
5
|
86.99
|
1
|
|
|
Puerarostan
|
366.40
|
4.7
|
2
|
6
|
93.04
|
3
|
|
|
[5-Hydroxy-3,4,6-tris[(3,4,5-trihydroxybenzoyl)oxy]oxan-2-yl]methyl 3,4,5-trihydroxybenzoate
|
788.60
|
1.5
|
13
|
22
|
377.42
|
13
|
|
|
3,4,6-tri-O-galloyl-beta-d-glucose
|
636.50
|
0.4
|
11
|
18
|
310.66
|
10
|
|
|
6-[5,6-Dihydroxy-2-(2-hydroxyphenyl)-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
|
462.40
|
0.8
|
7
|
12
|
207.35
|
4
|
|
|
2H,10H-[1,3]Dioxolo[4,5-B]xanthen-10-one
|
240.21
|
3.2
|
0
|
4
|
48.67
|
0
|
|
|
Dimethoxyxanthone
|
256.25
|
2.9
|
0
|
4
|
48.67
|
2
|
|
|
[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
|
618.80
|
5.7
|
5
|
8
|
136.68
|
4
|
|
|
2-[2-[[3,12-Dihydroxy-17-(2-hydroxy-6-methylhept-5-en-2-yl)-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol
|
771.00
|
2.7
|
9
|
13
|
218.99
|
9
|
|
|
N-[6-(2-hydroxy-4,5-dimethoxyphenyl)benzo[f][1,3]benzodioxol-5-yl]-N-methylformamide
|
381.40
|
3.6
|
1
|
6
|
77.46
|
4
|
|
|
1,8-Dihydroxy-2-(hydroxymethyl)-5-methoxyanthracene-9,10-dione
|
300.26
|
1.8
|
3
|
6
|
104.06
|
2
|
|
|
(1S,3S,4S,6S,7S,8R,11S,12S,15R,16R)-4-hydroxy-7,12,16-trimethyl-15-[(2R)-6-methylhept-5-en-2-yl]-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxypentacyclo[9.7.0.01,3.03,8.012,16]octadecane-7-carboxylic acid
|
604.80
|
5.8
|
5
|
8
|
136.68
|
7
|
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