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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
2-(Hydroxymethyl)-5-methoxy-8,8-dimethylpyrano[2,3-h]chromen-4-one
|
288.29
|
1.6
|
1
|
5
|
68.9
|
2
|
|
|
5,7-Dihydroxy-2-[3-hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
|
610.50
|
-2
|
11
|
16
|
280.43
|
6
|
|
|
Derride
|
352.30
|
3.2
|
0
|
6
|
67.13
|
2
|
|
|
13-Hydroxy-16,17-dimethoxy-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),5,9,14,16,18-heptaen-12-one
|
368.30
|
2.5
|
1
|
7
|
87.36
|
2
|
|
|
(1R,14R)-11,14-dihydroxy-17,18-dimethoxy-7,7-dimethyl-2,8,21-trioxapentacyclo[12.8.0.0^{3,12.0^{4,9.0^{15,20]docosa-3(12),4(9),5,10,15,17,19-heptaen-13-one
|
426.40
|
3.2
|
2
|
8
|
103.68
|
2
|
|
|
1-[(1S,2R,3S,4R)-2,3-dimethyl-4-(2,4,5-trimethoxyphenyl)cyclobutyl]-2,4,5-trimethoxybenzene
|
416.50
|
4.9
|
0
|
6
|
55.38
|
8
|
|
|
(3R,4S)-3-[(4-hydroxy-3-methoxyphenyl)methyl]-2,4-dihydrochromene-3,4,7-triol
|
318.32
|
1.2
|
4
|
6
|
99.38
|
3
|
|
|
(3R,4R)-3-[(4-hydroxy-3-methoxyphenyl)methyl]-2,4-dihydrochromene-3,4,7-triol
|
318.32
|
1.2
|
4
|
6
|
99.38
|
3
|
|
|
3'-O-Methylbrazilin
|
300.30
|
1.9
|
3
|
5
|
79.15
|
1
|
|
|
4-[(7-Hydroxy-2,2-dimethyl-4,9b-dihydro-[1,3]dioxolo[4,5-c]chromen-3a-yl)methyl]benzene-1,2-diol
|
344.40
|
2.5
|
3
|
6
|
88.38
|
2
|
|
|
Isopropylidene derivative of sappanol
|
344.40
|
2.5
|
3
|
6
|
88.38
|
2
|
|
|
(3aR,9bS)-3a-[(4-hydroxy-3-methoxyphenyl)methyl]-2,2-dimethyl-4,9b-dihydro-[1,3]dioxolo[4,5-c]chromen-7-ol
|
358.40
|
2.8
|
2
|
6
|
77.38
|
3
|
|
|
(3aR,9bS)-3a-[(4-hydroxyphenyl)methyl]-2,2-dimethyl-4,9b-dihydro-[1,3]dioxolo[4,5-c]chromen-7-ol
|
328.40
|
2.8
|
2
|
5
|
68.15
|
2
|
|
|
3-[(3,4-Dihydroxyphenyl)methyl]-2,4-dihydrochromene-3,4,7-triol
|
304.29
|
0.9
|
5
|
6
|
110.38
|
2
|
|
|
Sappanol
|
304.29
|
0.9
|
5
|
6
|
110.38
|
2
|
|
|
Episappanol
|
304.29
|
0.9
|
5
|
6
|
110.38
|
2
|
|
|
3-(4-Hydroxybenzyl)-3,4,7-chromantriol
|
288.29
|
1.3
|
4
|
5
|
90.15
|
2
|
|
|
3'-Deoxysappanol
|
288.29
|
1.3
|
4
|
5
|
90.15
|
2
|
|
|
(3E)-7-hydroxy-3-[(3-hydroxy-4-methoxyphenyl)methylidene]chromen-4-one
|
298.29
|
2.6
|
2
|
5
|
75.99
|
2
|
|
|
4'-Omethylbrazilin
|
300.30
|
1.9
|
3
|
5
|
79.15
|
1
|
|
|
3-[(4-Hydroxyphenyl)methyl]-4-methoxy-2,4-dihydrochromene-3,7-diol
|
302.32
|
1.8
|
3
|
5
|
79.15
|
3
|
|
|
3'-Deoxy-4-O-methylsappanol
|
302.32
|
1.8
|
3
|
5
|
79.15
|
3
|
|
|
(10S)-10-(hydroxymethyl)-8-oxatricyclo[10.4.0.02,7]hexadeca-1(16),2(7),3,5,12,14-hexaene-5,10,14,15-tetrol
|
304.29
|
1
|
5
|
6
|
110.38
|
1
|
|
|
5,10,14,15-Tetrahydroxy-8-oxatricyclo[10.4.0.02,7]hexadeca-1(16),2(7),3,5,12,14-hexaene-10-carbaldehyde
|
302.28
|
1.2
|
4
|
6
|
107.22
|
1
|
|
|
(10R)-5,10,14,15-tetrahydroxy-8-oxatricyclo[10.4.0.02,7]hexadeca-1(16),2(7),3,5,12,14-hexaene-10-carbaldehyde
|
302.28
|
1.2
|
4
|
6
|
107.22
|
1
|
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