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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[3-[4-[3-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino]propylamino]butylamino]propyl]prop-2-enamide
|
554.70
|
2.8
|
6
|
8
|
141.18
|
19
|
|
|
methyl (1S,4aR,5S)-5-[(3R)-5-hydroxy-3-methylpentyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate
|
336.50
|
5.2
|
1
|
3
|
46.53
|
7
|
|
|
1,3,9-Trihydroxy-2-(3-methylbut-2-enyl)-[1]benzofuro[3,2-c]chromen-6-one
|
352.30
|
4.3
|
3
|
6
|
104.04
|
2
|
|
|
[(3aR,4R,6E,9S,10Z,11aR)-9-acetyloxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (Z)-2-(hydroxymethyl)but-2-enoate
|
404.50
|
1.8
|
1
|
7
|
99.13
|
6
|
|
|
[(3aR,4R,6E,9S,10Z,11aR)-9-acetyloxy-10-(hydroxymethyl)-6-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (Z)-2-(hydroxymethyl)but-2-enoate
|
420.50
|
0.6
|
2
|
8
|
119.36
|
7
|
|
|
[(3aR,4R,6E,9S,10Z,11aR)-9-acetyloxy-10-(acetyloxymethyl)-6-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (E)-4-hydroxy-2-methylbut-2-enoate
|
462.50
|
1.2
|
1
|
9
|
125.43
|
9
|
|
|
(2-Methoxy-6,6-dimethylbenzo[c]chromen-9-yl)methanol
|
270.32
|
2.8
|
1
|
3
|
38.69
|
2
|
|
|
2-Methoxy-6,6-dimethylbenzo[c]chromene-9-carbaldehyde
|
268.31
|
3.1
|
0
|
3
|
35.53
|
2
|
|
|
(2R,3R)-2-ethenyl-3-[(E)-non-1-en-3,5,7-triynyl]oxirane
|
182.22
|
2.6
|
0
|
1
|
12.53
|
4
|
|
|
[(2R,3R,4S,5S)-5-[(2R,3R,4S,5R,6R)-4-acetyloxy-6-(acetyloxymethyl)-3,5-dihydroxyoxan-2-yl]oxy-3-hydroxy-4-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-5-(hydroxymethyl)oxolan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
|
778.70
|
0.2
|
6
|
19
|
272.73
|
19
|
|
|
[(2R,3R,4S,5S)-5-[(2R,3R,4S,5S,6R)-3,5-diacetyloxy-6-(acetyloxymethyl)-4-hydroxyoxan-2-yl]oxy-3-hydroxy-4-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-5-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]oxolan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
|
996.90
|
3
|
5
|
23
|
314.33
|
26
|
|
|
[(2S,3S,4R,5R)-2-[(2R,3R,4S,5S,6R)-3,5-diacetyloxy-6-(acetyloxymethyl)-4-hydroxyoxan-2-yl]oxy-4-hydroxy-3-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-5-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]oxolan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
|
966.90
|
3
|
5
|
22
|
305.1
|
25
|
|
|
3,5-Dioxa-11-azahexacyclo[9.9.2.02,6.08,21.014,22.015,20]docosa-1(21),2(6),7,9,14(22),15,17,19-octaene-12,13-dione
|
315.30
|
3.3
|
0
|
4
|
57.53
|
0
|
|
|
Methyl 2-methoxy-5-(4-methoxycarbonylphenoxy)benzoate
|
316.30
|
3.4
|
0
|
6
|
71.06
|
7
|
|
|
3-(4-hydroxy-3,5-dimethoxyphenyl)propyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
|
388.40
|
3.7
|
2
|
7
|
94.45
|
10
|
|
|
3-(4-hydroxy-3-methoxyphenyl)propyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
|
358.40
|
3.7
|
2
|
6
|
85.22
|
9
|
|
|
9-Methoxy-5-methyl-6H-indolo[3,2,1-de][1,5]naphthyridin-6-one
|
264.28
|
2.8
|
0
|
3
|
43.6
|
1
|
|
|
3-Ethyl-13-methoxy-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-3,5(16),6,8,10,12,14-heptaen-2-one
|
278.30
|
3.2
|
0
|
3
|
43.6
|
2
|
|
|
Bicuculline
|
367.40
|
2.6
|
0
|
7
|
66.46
|
1
|
|
|
Kinobeon A
|
356.40
|
3.2
|
0
|
6
|
71.06
|
6
|
|
|
Eriodictyol-6-glucoside
|
450.40
|
-0.4
|
8
|
11
|
197.37
|
3
|
|
|
[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methyl (Z)-3-(4-hydroxyphenyl)prop-2-enoate
|
340.32
|
-0.3
|
4
|
8
|
125.68
|
6
|
|
|
[(2R,3S,4S,5R,6S)-6-[4-(5,7-dihydroxy-4-oxochromen-2-yl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl acetate
|
504.40
|
0.9
|
5
|
12
|
185.35
|
7
|
|
|
(1S,2S,5S,8S,9R,11R,15S,16S,18R)-15,18-dihydroxy-16-methoxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one
|
362.50
|
1.8
|
2
|
5
|
75.99
|
1
|
|
|
[(E)-1-cyano-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyprop-1-enyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
|
437.40
|
-0.4
|
5
|
11
|
178.93
|
9
|
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