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Chemical Library

Physicochemical properties (MW, LogP) of all entries.

Total Rows 105,909
Pages 4,237
BIMP_ID Name Mol Weight LogP HBD HBA TPSA Rotatable Bonds
(1S,2S,6S,8R,10R,11S,14R,15R)-1,7,7,11,15-pentamethyl-14-[(2R)-4-oxopentan-2-yl]pentacyclo[8.7.0.02,6.06,8.011,15]heptadecane-5,9-dione
412.60
5
0
3
51.21
3
2-[(1R,2R)-3-oxo-2-[(Z)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxypent-2-enyl]cyclopentyl]acetic acid
564.60
0.5
5
12
189.28
14
(1aR,2R,3R,7bS)-2,3-dihydroxy-5-(2-phenylethyl)-1a,2,3,3a,7a,7b-hexahydrooxireno[2,3-f]chromen-7-one
302.32
0.6
2
5
79.29
3
(2S,3R,4S,5S,6R)-2-[[(9R,10R,11R)-3,11-dihydroxy-4,19-dimethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-5-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
550.60
1.6
6
12
176.76
5
(2E)-2-[(1R,3S,5R,6S,10R)-1-ethoxy-6-hydroxy-3-[(1E,3E)-4-[(1R,2R,5S)-2-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentyl]-2-methylbuta-1,3-dienyl]-10-(3-hydroxypropyl)-6-methyl-2-oxaspiro[4.5]decan-9-ylidene]propanal
530.70
4.1
3
6
96.22
10
(1S,13S,15S)-13-[(2E)-3,7-dimethylocta-2,6-dienyl]-6,7-dihydroxy-16,16-dimethyl-1,15-bis(3-methylbut-2-enyl)-3-oxatetracyclo[11.3.1.02,11.04,9]heptadeca-2(11),4,6,8-tetraene-10,12,17-trione
600.80
9.5
2
6
104.81
9
[(2S,3R,4S,5S,6R)-2-[[(1R,4S,4aS,8aS)-4-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,5,8,8a-hexahydronaphthalen-1-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-phenylprop-2-enoate
530.60
3.5
4
8
125.68
8
1,3,6-Trihydroxy-7-(3-methylbut-2-enoxy)xanthen-9-one
328.30
3.9
3
6
100.13
3
(1R,11S,12R,13R,18S)-18-hydroxy-8,16-dimethyl-14-oxapentacyclo[11.2.2.19,12.01,11.04,10]octadeca-4,7,9-triene-6,15-dione
312.40
0.2
1
4
63.6
0
(3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[[4-[5-[[(3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-2-oxooxolan-3-yl]methyl]-2-hydroxy-3-methoxyphenoxy]-3-methoxyphenyl]methyl]oxolan-2-one
742.80
7.1
1
12
137.44
16
(1R,11S,12R,13R,18R)-18-hydroxy-8,16-dimethyl-14-oxapentacyclo[11.2.2.19,12.01,11.04,10]octadeca-4,7,9-triene-6,15-dione
312.40
0.2
1
4
63.6
0
(1R,2R,3S,3aR,8bS)-6-[[(2S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-1,4-dioxan-2-yl]oxy]-1,8b-dihydroxy-8-methoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxamide
625.60
0.1
6
12
199.62
9
(2R,3R,4S,5S,6R)-2-[[(1R,2S,4S,4aR,5S,8aR)-4-hydroxy-4a,8-dimethyl-2-propan-2-yl-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,3,4,5,6,8a-hexahydro-1H-naphthalen-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
548.60
-1.5
8
12
198.76
6
(1S,11S,12R,13S,18R)-17,18-dihydroxy-8,16-dimethyl-14-oxapentacyclo[11.2.2.19,12.01,11.04,10]octadeca-4,7,9-triene-6,15-dione
328.40
-0.7
2
5
83.83
0
(3R,4R)-3-[[3-[5-[[(3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-2-oxooxolan-3-yl]methyl]-2-hydroxy-3-methoxyphenyl]-4-hydroxy-5-methoxyphenyl]methyl]-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
728.80
6.6
3
12
159.44
14
3-(3,4-Dihydroxyphenyl)-5-hydroxy-6,8,8-tris(3-methylbut-2-enyl)chromene-4,7-dione
490.60
6.6
3
6
107.97
7
[(3aR,5R,5aS,7R,8R,8aS,9aR)-8-acetyloxy-5,8a-dimethyl-1-methylidene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-7-yl] acetate
350.40
2.8
0
6
78.9
4
(4aS,8aR)-5,5,8a-trimethyl-1,2,4,4a,6,7,8,9-octahydrocyclopenta[b]naphthalen-3-one
232.36
3.9
0
1
17.07
0
(2E)-2-[(1R,3S,5R,6S,10R)-6-hydroxy-3-[(1E,3E)-4-[(1S,2S,5R)-2-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentyl]-2-methylbuta-1,3-dienyl]-10-(3-hydroxypropyl)-1-methoxy-6-methyl-2-oxaspiro[4.5]decan-9-ylidene]propanal
516.70
3.8
3
6
96.22
9
(1S,4aR,6aR,6aS,6bR,8R,8aR,9R,10S,12aR,14bS)-1,8,10-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
504.70
4.1
5
6
118.22
2
(8S,9R)-8-(2-Acetoxypropan-2-yl)-2-oxo-8,9-dihydro-2H-furo[2,3-h]chromen-9-yl isobutyrate
374.40
3
0
7
92.04
6
7-Methoxy-3-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one
350.40
5
0
4
48.67
5
(2S,3R,4S,5R)-2-[[(3S,6S,7S,8S,11R,12S,15R,16R)-3-hydroxy-15-[(2R,4R)-4-hydroxy-6-methyl-5-methylideneheptan-2-yl]-7,12,16-trimethyl-6-tetracyclo[9.7.0.03,8.012,16]octadec-1(18)-enyl]oxy]oxane-3,4,5-triol
590.80
5.2
5
7
119.61
7
11-Methyl-1,2,3,5,6,6a-hexahydrochromeno[2,3-g]indolizin-12-one
255.31
2.5
0
3
29.54
0
(1'S,2R,4R,5'R,9'R)-5,5',7-trihydroxy-10',10'-dimethyl-6'-methylidene-4-phenylspiro[3,4-dihydrochromene-2,2'-bicyclo[7.2.0]undecane]-6,8-dicarbaldehyde
490.60
5.7
3
6
104.06
3
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