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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
(1R,3aR,5aR,5bR,7aS,9S,11R,11aS,11bS,12R,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-9,11,12-triol
458.70
7.6
3
3
60.69
1
2,6-Dihydroxy-8-methoxy-10,11-dioxa-benzo[b]fluoren-5-one
298.25
3.5
2
6
93.04
1
7,3',5'-Trihydroxyflavanone
272.25
1.8
3
5
86.99
1
(1R,3aS,5aR,5bR,7aR,8S,9R,11aR,11bR,13aR,13bR)-9-acetyloxy-1-(3-hydroxyprop-1-en-2-yl)-5a,5b,8,11a-tetramethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a,8-dicarboxylic acid
544.70
6.2
3
7
121.13
6
(2S,3R,5R,9R,10R,13R,14S,17S)-2,3,14-trihydroxy-10,13-dimethyl-17-[(2R,3R,5S)-2,3,6-trihydroxy-5-(hydroxymethyl)-6-methylheptan-2-yl]-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
510.70
-0.3
7
8
158.68
6
6-Hydroxymethyleugenin
236.22
1.2
2
5
79.9
2
Chamaechromone
542.50
4.9
7
10
188.89
6
(E,E,E)-7-carboxy-3,11,15-trimethyl-2,6,10,14-hexadecatetraen-1-ol
320.50
5.3
2
3
57.53
11
(3R,3aR,5aR,5bR,7aR,11aS,13aS,13bR)-3a,5a,8,8,11a,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysene
410.70
10.5
0
0
0
1
Fern-9(11)-en-12-one
424.70
9.4
0
1
17.07
1
11-Pentacosanone
366.70
11.4
0
1
17.07
22
(-)-Maalioxide
222.37
4.1
0
1
9.23
0
[(1R,3S,4aS,6aS,6bR,8aR,11R,12S,12aR,14bS)-1-hydroxy-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a-dodecahydro-1H-picen-3-yl] octadecanoate
707.20
16.7
1
3
46.53
18
Agallochin O
332.50
4.5
1
3
46.53
6
Leptanthine
315.36
-1.8
4
7
110.46
6
Chlorophyll a
893.50
0
9
123.65
22
3-O-(E)-p-Coumaroylbetulin
588.90
10.6
2
4
66.76
6
Agrostophyllinone
438.70
9.4
0
1
17.07
5
methyl (1R,2S,3R,6R,8S,9S,13S,14R,15R,16S,17S)-15,16-dihydroxy-9,13-dimethyl-3-(3-methylbut-2-enoyloxy)-4,10-dioxo-11-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-11-ene-17-carboxylate
652.60
0.2
5
15
224.81
7
methyl (1R,2S,3R,6R,8S,9S,13S,14R,15R,16S,17S)-3-[(E)-4-acetyloxy-3,4-dimethylpent-2-enoyl]oxy-15,16-dihydroxy-9,13-dimethyl-4,10-dioxo-11-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-11-ene-17-carboxylate
738.70
0.1
5
17
251.11
10
(+)-pinoresinol di-O-beta-d-glucopyranoside
682.70
-1.3
8
16
235.68
10
5-Hydroxy-3-[5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4-oxochromen-6-yl]-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
594.60
6.4
2
10
137.8
7
Methyl 6,7-didehydro-2,20-cycloaspidospermidine-3-carboxylate
336.40
2.9
1
4
41.57
2
3-[(4-Hydroxyphenyl)methyl]-1-phenylpyrrole-2,5-dione
279.29
2.6
1
3
57.61
3
(E,4S)-4-hydroxy-N-(2-methylpropyl)hex-2-enamide
185.26
1.4
2
2
49.33
5
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