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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
5-(12,15-Heneicosadienyl)-1,3-benzenediol
400.60
10.7
2
2
40.46
18
Epiafzelechin-(4b->8)-epicatechin 3,3'-digallate
866.70
5.1
13
19
334.05
9
Gomphrenin II
696.60
0.9
8
16
275.68
10
Thesinine 4'-O-glucoside
449.50
1
4
9
128.92
8
Flavone base + 3O, 1MeO, O-HexA-FeruloylHexA
828.70
2
9
21
328.1
13
(-)-Pisumionoside
404.50
-1.6
6
9
156.91
5
Carotamine
271.27
2.3
4
5
118.44
3
beta-D-Glucopyranosyl-11-hydroxyjasmonic acid
388.40
-1.3
5
9
153.75
8
(1R,3R,4R,5S,6S,8x)-1-Acetoxy-8-angeloyloxy-3,4-epoxy-5-hydroxy-7(14),10-bisaboladien-2-one
406.50
3.1
1
7
102.43
9
6'-Hmg sdg
830.80
-1.7
11
20
321.28
21
(8R,8'R)-Secoisolariciresinol 9,9'-bis-[4-carboxy-3-hydroxy-3-methylbutanoyl-(->6)-glucoside]
974.90
-2.6
12
24
384.88
27
5-Hydroxy-4,4',6-trimethoxyaurone
328.30
3.2
1
6
74.22
4
3,5,7-Trihydroxy-4',6-dimethoxyflavanone
332.30
2.1
3
7
105.45
3
(2E,5Z)-hepta-2,5-dien-1-ol
112.17
1.4
1
1
20.23
3
Ginsenoyne J
246.40
5.7
1
1
20.23
9
Ginsenoyne I
262.40
4.7
1
2
32.76
9
4-Methoxy-3-(3-methyl-1,3-butadienyl)-2(1H)-quinolinone
241.28
3.1
1
2
42.09
3
Columbaridione
344.40
2.5
1
5
80.67
1
(3beta,24(241)Z)-24-Ethylidenelanost-9(11)-en-3-ol
454.80
10
1
1
20.23
5
Theogallinin
800.60
1.1
15
21
382.35
9
Theaflavonin
936.70
1.9
17
24
428.11
9
(+)-Notoginsenoside R4
1241.40
-1.8
17
27
436.21
18
Saponin D
927.10
2.5
9
17
255.91
8
Saponin G
781.00
3.6
7
13
196.99
6
[6-[2-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoate
902.80
-0.4
12
22
354.65
13
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