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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,4R,6S,8S,11S,12S,13R,16S,17R)-6,17-dihydroxy-8,16-dimethyl-14-oxapentacyclo[11.2.2.19,12.01,11.04,10]octadec-9-ene-15,18-dione
332.40
0.6
2
5
83.83
0
(1R,3R,4S,5R)-4-[(1R,5R,6R,7S)-7-(3,4-dihydroxyphenyl)-1-(hydroxymethyl)-4-oxo-8-oxabicyclo[3.2.1]oct-2-ene-6-carbonyl]oxy-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,5-dihydroxycyclohexane-1-carboxylic acid
642.60
-0.1
8
15
257.81
10
(1R,6R,8S,11R,12R,15R,16R)-15-[(2R,5S)-6-hydroxy-6-methyl-5-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyheptan-2-yl]-7,7,16-trimethyl-6-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxytetracyclo[9.7.0.03,8.012,16]octadec-3-ene-12-carboxylic acid
754.90
2.5
8
13
215.83
10
2-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3-dimethoxy-5-[(E)-2-phenylethenyl]benzene
376.50
7.9
0
2
18.46
9
2-[(2R)-6-(2-methylbut-3-en-2-yl)-7-oxo-2,3-dihydrofuro[3,2-g]chromen-2-yl]propan-2-yl 2-pyridin-2-ylethyl carbonate
463.50
5.8
0
7
87.86
9
(1S,2S,8aS)-1-[[(1R,4aR,8aS)-6-methoxy-8a-(7-methoxy-4-oxochromen-2-yl)-2-methyl-5,8-dioxo-4,4a-dihydro-1H-naphthalen-1-yl]methyl]-1,5,5-trimethyl-2,3,6,7,8,8a-hexahydronaphthalene-2-carboxylic acid
614.70
5.7
1
8
120.11
6
(1R,4R,5R,8R,10S,13R,14R,17R,18S,19S,20R,24R)-10,24-dihydroxy-4,5,9,9,13,19,20-heptamethyl-21-oxahexacyclo[18.2.2.01,18.04,17.05,14.08,13]tetracosan-22-one
472.70
6.7
2
4
66.76
0
(10aS)-1-ethenyl-7,10a-dihydroxy-2,8-dimethyl-9,10-dihydrophenanthren-3-one
282.30
2.1
2
3
57.53
1
2-[(2R)-6-(2-methylbut-3-en-2-yl)-7-oxo-2,3-dihydrofuro[3,2-g]chromen-2-yl]propan-2-yl 3-methylbut-2-enoate
396.50
5.9
0
5
65.74
6
dimethyl (3aS,8bS)-8b-hydroxy-6-methoxy-3a-methyl-1,2-dihydropyrrolo[2,3-b]indole-3,4-dicarboxylate
336.34
0.8
1
6
88.54
3
(1R,11R,13R,14R,15R,16R)-15-ethyl-13-(hydroxymethyl)-7-methoxy-17-methyl-3,17-diazapentacyclo[12.3.1.02,10.04,9.011,16]octadeca-2(10),4(9),5,7-tetraen-12-one
354.40
2.7
2
4
65.56
3
(5S)-1-(3,4-dihydroxy-5-methoxyphenyl)-5-hydroxydecan-3-one
310.40
2.7
3
5
86.99
10
[(2S,4aS,6aS,7R,9S,10R,10aR,10bS)-10-acetyloxy-2-(furan-3-yl)-4a,9-dihydroxy-10b-methyl-4-oxo-1,2,5,6,6a,7,8,9,10,10a-decahydrobenzo[f]isochromen-7-yl] (E)-3-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoate
732.70
1
6
16
241.11
11
[(1R,2R,3R,7S,8R,9S,11S,13R)-1,2,9-trihydroxy-9,13-dimethyl-4-methylidene-5-oxo-6,14-dioxatricyclo[9.2.1.03,7]tetradecan-8-yl] 2-methylpropanoate
384.40
0.8
3
8
122.52
3
(2Z)-2-[(1R,3R,5R,10R,14S)-14-hydroxy-3-[(1E,3E)-4-[(1S,2S,5R)-2-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentyl]-2-methylbuta-1,3-dienyl]-14-methyl-4,6-dioxatricyclo[8.4.0.01,5]tetradecan-11-ylidene]propanal
484.70
4.2
2
5
75.99
5
[(1S)-1-[(2S,5R)-5-[(S)-hydroxy-[(2R)-6-oxo-2,3-dihydropyran-2-yl]methyl]oxolan-2-yl]ethyl] (E)-3-(4-methoxyphenyl)prop-2-enoate
402.40
3
1
7
91.29
8
2-[(2R)-6-(2-methylbut-3-en-2-yl)-7-oxo-2,3-dihydrofuro[3,2-g]chromen-2-yl]propan-2-yl N-[2-(4-fluorophenyl)ethyl]carbamate
479.50
6.3
1
6
77.77
8
2-hydroxy-3-[(2E,6S)-6-hydroxy-3,7-dimethylocta-2,7-dienyl]-4-methoxy-6-(2-phenylethyl)benzoic acid
424.50
6.6
3
5
86.99
11
2,5,7-trihydroxy-6,8-dimethyl-2-[(Z)-pentadec-10-enyl]-3H-chromen-4-one
432.60
8.1
3
5
86.99
13
7,10,12-Trihydroxy-2,2-dimethyl-8-(2-methylbut-3-en-2-yl)pyrano[3,2-b]xanthen-6-one
394.40
5.3
3
6
100.13
2
(1R,6R,11R,12R,15R,16R)-6-[(2R,3R,4S,5S,6R)-6-(acetyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-15-[(2R,5S)-6-hydroxy-6-methyl-5-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyheptan-2-yl]-7,7,16-trimethyltetracyclo[9.7.0.03,8.012,16]octadec-3(8)-ene-12-carboxylic acid
827.00
2
8
15
242.13
13
4-hydroxy-N-[(2S)-2-hydroxy-2-phenylethyl]benzamide
257.28
1.7
3
3
69.56
4
methyl (1S,3'S,12R,14S,15R,16S,19S)-12-[(2R,3E,5R,12bS)-3-ethylidene-9-hydroxy-2-(2-hydroxyethyl)-5-methyl-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-5-ium-8-yl]-3',20-dimethylspiro[17-oxa-10,20-diazapentacyclo[14.3.1.03,11.04,9.014,19]icosa-3(11),4,6,8-tetraene-15,2'-oxirane]-19-carboxylate
707.90
3.8
4
7
123.34
5
(7aR,11aR)-3-(3,4-dihydroxyphenyl)-6-hydroxy-8,8,11a-trimethyl-7a,9,10,11-tetrahydro-7H-pyrano[2,3-c]xanthen-1-one
422.50
4.8
3
6
100.13
1
(1S,4R,6R,8S,11S,12S,13R,16S,17R)-6,17-dihydroxy-8,16-dimethyl-14-oxapentacyclo[11.2.2.19,12.01,11.04,10]octadec-9-ene-15,18-dione
332.40
0.6
2
5
83.83
0
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