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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,2R,7S,8S,15S,17R,20R,21R,24S,27R,28R,29R,32R)-7-(3,4-dihydroxyphenyl)-8,11-dihydroxy-1,16,16,20,21-pentamethyl-3-oxo-27-prop-1-en-2-yl-6,14-dioxaoctacyclo[15.15.0.02,15.04,13.05,10.020,32.021,29.024,28]dotriaconta-4(13),5(10),11-triene-24-carboxylic acid
740.90
9.2
5
9
153.75
3
(Z)-5-[(1S,4aR,5S,8aR)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enoic acid
320.50
4.9
2
3
57.53
5
[(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-yl] (Z)-3-(3,4-dihydroxyphenyl)prop-2-enoate
604.90
10.2
3
5
86.99
6
Ethyl hexacosanoate
424.70
13.2
0
2
26.3
26
[(3aS,4R,6R,7E,10Z,11aS)-6-hydroxy-6,10-dimethyl-3-methylidene-2,9-dioxo-3a,4,5,11a-tetrahydrocyclodeca[b]furan-4-yl] 2-methylpropanoate
348.40
2.1
1
6
89.9
3
(4aS,5S,6R,8aS)-5-[2-(furan-3-yl)ethyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid
316.40
5.6
1
3
50.44
4
(3S)-3-[(3,4-dihydroxyphenyl)methyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one
302.28
2.5
4
6
107.22
2
3-[(2R)-2-hydroxy-3-methylbut-3-enyl]-4,8-dimethoxy-1-methylquinolin-2-one
303.35
2.1
1
4
60.69
5
(3R)-3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
356.40
4.1
4
6
107.22
3
(1S)-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-1H-isoquinolin-7-ol
327.40
3.3
2
5
62.16
4
(2R)-4-hydroxy-6-(4-hydroxyphenyl)-2-(2-hydroxypropan-2-yl)-9-(3-methylbut-2-enyl)-2,3-dihydrofuro[3,2-g]chromen-5-one
422.50
5
3
6
100.13
4
Gal(a1-6)D-Ido(a1-6)Glc(a1-2b)Psif
666.60
-8
14
21
347.83
11
(1R,7S,15R,19R,26S,27R,31R,32R)-7,19,27-tris(3,4-dihydroxyphenyl)-6,8,18,20,28-pentaoxaoctacyclo[17.11.1.17,15.02,17.05,16.09,14.021,30.024,29]dotriaconta-2(17),3,5(16),9,11,13,21(30),22,24(29)-nonaene-3,11,13,23,26,31,32-heptol
862.70
3.4
13
18
309.14
3
(E,6R)-2-methyl-6-[(1S,3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-6-[(Z)-octadec-13-enoyl]oxy-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]hept-2-enoic acid
721.10
16.5
1
4
63.6
22
(6R)-6-[(1S,3R,6S,8R,11S,12S,15R,16R)-6-acetyloxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-2-methyl-3-methylideneheptanoic acid
512.80
9.8
1
4
63.6
8
2-[17-(2-Hydroxy-2,6,6-trimethyl-7-oxabicyclo[2.2.1]heptan-1-yl)-6,11,15-trimethylheptadeca-2,4,6,8,10,12,14,16-octaen-2-yl]-4,4,7a-trimethyl-2,5,6,7-tetrahydro-1-benzofuran-6-ol
600.90
9.4
2
4
58.92
9
[4-Sulfooxyimino-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylbutyl] benzoate
481.50
0
5
13
226.09
11
CID 132993930
492.40
0.8
6
12
188.51
6
4(15),5,10(14)-Germacratrien-1-ol
220.35
3.7
1
1
20.23
1
6,9-Dihydroxy-6,9-dimethyl-3-methylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one
266.33
1.2
2
4
66.76
0
Soyasaponin gamma-G
923.10
4.1
9
17
271.59
9
8a-[3-[4-[3,4-Dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-6-methyl-5-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxycarbonyl-3-[3-[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,8-dihydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid
1547.60
-5.8
22
38
608.42
20
3-[3-[4,5-Dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-8a-[3-[3,4-dihydroxy-6-methyl-5-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxycarbonyl-2-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid
1399.50
-3.9
19
33
529.27
17
Orbicuside B
558.60
0.5
3
10
140.35
1
Gitostin
875.00
-2.4
10
19
293.21
10
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