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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
1,3,5,8-Tetrahydroxy-6-methoxy-2-methylanthraquinone
316.26
2.9
4
7
124.29
1
3-(7-Methoxy-2-oxochromen-8-yl)-2,2-dimethylpropanoic acid
276.28
2.6
1
5
76.74
4
3,8,9-Trihydroxy-6-methoxy-3-methyl-10-(2,5,10-trihydroxy-7-methoxy-2-methyl-4-oxo-1,3-dihydroanthracen-9-yl)-2,4-dihydroanthracen-1-one
574.60
4.3
6
10
173.98
3
[(3aS,5R,5aR,7R,8aS,9aR)-8a-hydroxy-1,8-dimethylidene-2-oxospiro[4,5a,6,7,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-5,2'-oxirane]-7-yl] acetate
320.30
0.2
1
6
85.36
2
[(3aS,5aS,7R,8aS,9aR)-8a-hydroxy-1,5,8-trimethylidene-2-oxo-4,5a,6,7,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-7-yl] acetate
304.34
0.8
1
5
72.83
2
[(3aS,5R,5aR,7R,8aS,9aR)-8a-hydroxy-1,8-dimethylidene-2-oxospiro[4,5a,6,7,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-5,2'-oxirane]-7-yl] propanoate
334.40
0.6
1
6
85.36
3
(3aS,5S,6aR,9S,9aR,9bR)-5-hydroxy-9-methyl-3,6-dimethylidene-3a,4,5,6a,7,9,9a,9b-octahydroazuleno[4,5-b]furan-2,8-dione
262.30
0.7
1
4
63.6
0
(3aS,5R,5aR,7R,8aS,9aR)-7,8a-dihydroxy-1,8-dimethylidenespiro[4,5a,6,7,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-5,2'-oxirane]-2-one
278.30
-0.4
2
5
79.29
0
5,8a-Dimethyl-5-(4-methylpent-3-enyl)-1,4,4a,6,7,8-hexahydronaphthalene-1,2-dicarbaldehyde
302.50
5.2
0
2
34.14
5
11-Ethyl-13-methyl-4-methylidene-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,16-diol
343.50
2.4
2
3
43.7
1
2-Acetylpyridine
121.14
0.9
0
2
29.96
1
CID 14286063
374.50
2.9
0
5
65.13
2
Gelomulide A
374.50
2.9
0
5
65.13
2
(1S,3R,8R,10S,11R,16S)-5,11,15,15-tetramethyl-2,7-dioxapentacyclo[8.8.0.01,3.04,8.011,16]octadec-4-ene-6,14-dione
330.40
2
0
4
55.9
0
[(1S,3R,8R,10S,11R,12R,16S)-5,11,15,15-tetramethyl-6,14-dioxo-2,7-dioxapentacyclo[8.8.0.01,3.04,8.011,16]octadec-4-en-12-yl] acetate
388.50
1.6
0
6
82.2
2
Gelomulide B
388.50
2.2
0
6
77.66
2
(1S,3R,8R,10S,11R,16S)-5,11,15,15-tetramethyl-2,7-dioxapentacyclo[8.8.0.01,3.04,8.011,16]octadeca-4,12-diene-6,14-dione
328.40
2.2
0
4
55.9
0
methyl (1S,11S,17R,18S)-18-ethyl-6-methoxy-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2(7),3,5,9-tetraene-10-carboxylate
354.40
3
1
5
50.8
4
methyl (3S,3aR,7aS)-7a-ethenyl-3-(1H-indol-2-yl)-6-methyl-3a,4,5,7-tetrahydro-2H-furo[2,3-c]pyridine-3-carboxylate
340.40
2.3
1
4
54.56
4
[(6S,8R,11R,12S,14R,15S,16R)-6-benzamido-15-[(1S)-1-(dimethylamino)ethyl]-7,7,12,16-tetramethyl-14-tetracyclo[9.7.0.03,8.012,16]octadeca-1(18),3-dienyl] acetate
546.80
6.7
1
4
58.64
6
1-(6,10,15,19-Tetramethyl-17-oxa-19-azapentacyclo[12.8.0.03,11.06,10.015,20]docosa-1,3-dien-7-yl)ethanone
397.60
4.5
0
3
29.54
1
[(3S,5R,9R,10R,13S,14S,17S)-4,4,10,13,14-pentamethyl-17-[(2S)-6-methylhept-5-en-2-yl]-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
468.80
9.8
0
2
26.3
6
[(4aS,9S,10aS)-6-acetyloxy-1,1,4a-trimethyl-5,8-dioxo-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-9-yl] acetate
416.50
4.4
0
6
86.74
5
(-)-Isolongifolen-9-one
218.33
3.6
0
1
17.07
0
Pedunculoside
650.80
3.5
7
10
177.14
5
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