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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
Aurochrome
568.90
11.3
0
2
18.46
8
Reticulataxanthin
472.70
9.2
1
2
37.3
10
[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 5,17-dihydroxy-11-methyl-6-methylidene-12-oxo-13-oxapentacyclo[9.3.3.15,8.01,10.02,8]octadecane-9-carboxylate
524.60
-1.3
6
11
183.21
4
Cymbopogonol
426.70
9.3
1
1
20.23
1
7',8'-Dihydro-e,y-carotene
538.90
14.6
0
0
0
14
Capsochrome
600.90
9.7
2
4
66.76
10
psi,psi-Carotene-16,16'-diol
568.90
13.1
2
2
40.46
18
Kryptocapsin
568.90
11.9
1
2
37.3
11
delta-Carotene-1,2-epoxide
552.90
13.3
0
1
12.53
13
(6Z,10Z,12E,14E,16E,18E,20Z,22E,26Z)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene
540.90
15.5
0
0
0
18
11,12-Dihydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid
364.40
1.3
4
6
115.06
2
8-Formyl-11,12-dihydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid
378.40
-0.3
4
7
132.13
3
Eleutheroside L
1205.40
-0.7
14
25
392.59
13
Sucrose 1',4'-(4,4'-dihydroxy-3,3'-dimethoxy-b-truxinate)
694.60
-1.6
8
17
260.59
8
Cafamarine
508.60
-0.1
6
10
170.05
5
4,5-Dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid
348.40
0.2
3
6
104.06
1
Glycinoeclepin B
558.70
3.2
3
9
147.43
10
Glycinoeclepin C
514.60
2.5
3
8
130.36
5
Cymbopogone
426.70
9.7
0
1
17.07
1
(8S,8'S)-Secoisolariciresinol 9-xyloside
494.50
1
6
10
158.3
11
cis-p-Coumaric acid 4-[apiosyl-(1->2)-glucoside]
458.40
-1.5
7
12
195.6
8
Delphinidin 3-(6-p-coumaroylgalactoside)
611.50
9
13
238.13
8
Debenzoylzucchini factor B
559.80
8.5
2
4
72.55
4
5-[[6-[3-[[6-[[5-[[6-[2,3-Bis[(4-hydroxy-3-methoxyphenyl)methyl]-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoyl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxymethyl]-4-(4-hydroxy-3-methoxyphenyl)-2-[(4-hydroxy-3-methoxyphenyl)methyl]butoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid
1643.60
-3.1
20
39
611.33
44
1-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-2,2-dimethyl-6-methylidenecyclohexane-1,4-diol
584.90
10.1
3
3
60.69
10
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