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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
(3S,3aR,4S,7R,10E,11aR)-7-hydroperoxy-4-hydroxy-3,10-dimethyl-6-methylidene-3,3a,4,5,7,8,9,11a-octahydrocyclodeca[b]furan-2-one
282.33
1
2
5
75.99
1
(3R,3aS,5aR,6R,9bS)-6-hydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,8,9b-octahydrobenzo[g][1]benzofuran-2-one
250.33
1.7
1
3
46.53
0
(3R,3aS,5aR,9bS)-3,5a,9-trimethyl-3a,4,5,7,8,9b-hexahydro-3H-benzo[g][1]benzofuran-2,6-dione
248.32
1.4
0
3
43.37
0
Geranylgeranyl octadecanoate
556.90
15.6
0
2
26.3
28
(2E,6E,10E)-3,7,11,15-Tetramethylhexadeca-2,6,10,14-tetraen-1-yl formate
318.50
7.2
0
2
26.3
12
trans-Methylbixin
408.50
7.9
0
4
52.6
12
3-Hydroxy-6-acetoxytropane
199.25
0.4
1
4
49.77
2
2-hydroxy-1,3,10-trimethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one
357.40
1
2
6
77.02
4
(7S)-3-hydroxy-1,2,10-trimethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one
357.40
1
2
6
77.02
4
(10R)-4,5,16-trimethoxy-11-methyl-11-azatetracyclo[8.7.1.02,7.014,18]octadeca-1(18),2,4,6,14,16-hexaene-3,17-diol
371.40
3
2
6
71.39
3
[(1R,12S,14R)-9-hydroxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-yl] acetate
315.40
2.1
1
5
59
2
5,7-Dihydroxy-7-methyl-1,4,4a,5,6,7a-hexahydrocyclopenta[c]pyran-3-one
186.20
-0.6
2
4
66.76
0
Methyl 4-prenyloxycinnamate
246.30
3.7
0
3
35.53
6
Dihydromalyngic acid
330.50
3.1
4
5
97.99
15
1,4-Epidioxy-p-mentha-2,8-diene
166.22
2.4
0
2
18.46
1
1,2:3,4-Diepoxy-p-menth-8-ene
166.22
1.5
0
2
25.06
1
2-(Hydroxymethyl)-6-[[5-hydroxy-2-methyl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-10-yl]oxy]oxane-3,4,5-triol
524.50
-4.8
9
15
240.75
6
[(2S,3R,4R,5R,6S)-4,5-dihydroxy-2-[[(1S,2S,4S,5S,6R,10S)-2-(hydroxymethyl)-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl]oxy]-6-methyloxan-3-yl] (E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoate
684.60
-2
8
17
256.05
11
Arctiol
238.37
3.1
2
2
40.46
1
2-(5-acetyloxy-4,6b-dimethyl-1a,2,4,5,6,6a-hexahydro-1H-cyclopropa[e]inden-2-yl)prop-2-enoic acid
290.40
2.5
1
4
63.6
4
2-[(1aR,2S,4R,5S,6aS,6bR)-5-acetyloxy-4,6b-dimethyl-1a,2,4,5,6,6a-hexahydro-1H-cyclopropa[e]inden-2-yl]prop-2-enoic acid
290.40
2.5
1
4
63.6
4
2-(3-Acetyloxy-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)prop-2-enoic acid
292.40
3.2
1
4
63.6
4
2-[(2R,3R,4aR,8aS)-3-acetyloxy-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid
292.40
3.2
1
4
63.6
4
2-(3-acetyloxy-4a,8-dimethyl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-2-yl)prop-2-enoic acid
292.40
2.9
1
4
63.6
4
(3aS,5E,7S,10E,11aS)-7-hydroxy-6,10-dimethyl-3-methylidene-3a,4,7,8,9,11a-hexahydrocyclodeca[b]furan-2-one
248.32
1.7
1
3
46.53
0
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