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SCFBio, IIT Delhi Hauz Khas, New Delhi

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-Palmitoyl-2-stearoyl-3-arachidonyl-glycerol
891.50
25.2
0
6
78.9
56
1-Palmitoyl-2-arachidonyl-3-arachidonyl-glycerol
919.50
26.3
0
6
78.9
58
1-Stearoyl-2-stearoyl-3-arachidonyl-glycerol
919.50
26.3
0
6
78.9
58
1-Stearoyl-2-arachidonyl-3-arachidonyl-glycerol
947.60
27.4
0
6
78.9
60
S-[2-[3-[[(2R)-4-[[[(2R,4S,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-hydroxybenzenecarbothioate
887.60
-4.3
10
23
438.59
21
Apigenin 6-C-glucoside 8-C-arabinoside
564.50
-1.6
10
14
250.97
5
Sesamolinol 4'-O-b-D-glucosyl (1->6)-O-b-D-glucoside
696.60
-1.2
7
17
233.91
10
asparagoside F
1035.20
-0.9
12
22
335.06
11
Nummularine A
647.80
4.8
4
7
138.1
11
Acuminoside
448.50
-0.5
6
10
158.3
10
Neryl rhamnosyl-glucoside
462.50
-0.3
6
10
158.3
9
Alkaloid RC
531.50
0.3
4
12
148.77
3
Solacauline
824.00
1.4
8
15
220.46
7
Chlorogenoquinone
352.29
-1.7
4
9
158.43
5
(S)-a-Amino-2,5-dihydro-5-oxo-4-isoxazolepropanoic acid N2-glucoside
334.28
-5
6
11
188.61
5
4-[(E)-2-[2-carboxy-6-hydroxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydroindol-1-yl]ethenyl]pyridine-2,6-dicarboxylic acid
548.50
-0.2
8
15
247.64
8
7-{[(2Z)-5-(3-hydroxy-2,2-dimethyl-6-methylidenecyclohexyl)-3-methylpent-2-en-1-yl]oxy}-2H-chromen-2-one
382.50
5.3
1
4
59.67
6
Formononetin 7-(6''-malonylglucoside)
516.40
0.7
4
12
182.19
9
3'-Methoxyfukiic acid
286.23
-0.5
5
8
144.52
6
6''-Malonylgenistin
518.40
0.6
6
13
213.42
8
3-O-Methylcoumestrol
282.25
3.1
1
5
72.81
1
Asparagusic acid syn-S-oxide
166.20
-0.8
1
5
98.88
1
5alpha-Ethoxy-6beta-hydroxy-5,6-dihydrophysalin B
572.60
0.1
2
11
154.89
2
2'',6''-Digalloyliriflophenone 3-C-glucoside
712.60
1.7
12
18
321.66
10
2'',3'',6''-Trigalloyliriflophenone 3-C-glucoside
864.70
2.9
14
22
388.42
13
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