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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
Sitosterol 3-O-(6'-O-palmitoyl-beta-D-glucoside)
815.30
15.1
3
7
105.45
25
Sitosterol 3-O-(6'-O-stearyl-beta-D-glucoside)
843.30
16.2
3
7
105.45
27
alpha-Taraxasterol
426.70
9.1
1
1
20.23
0
Apigenin 6-C-arabinosyl-8-C-glucoside
696.60
-2.8
12
18
309.89
8
Benzyladenine 7-O-beta-D-glucoside
387.40
-0.4
5
9
145.78
5
Soyasaponin A-d
1407.50
-0.6
13
32
477.56
22
Soyasaponin gamma-A
893.10
4.2
8
16
251.36
8
Kaurenoic acid thujanol ester
438.70
8.4
0
2
26.3
4
23-Dehydrocampestanol
400.70
9.1
1
1
20.23
4
23-Dehydrocholesterol
384.60
7.9
1
1
20.23
4
24-Ethyl-24(25)-dehydrolathosterol
412.70
8.9
1
1
20.23
5
24-Methyl-trans-22-dehydrocholesterol
398.70
8
1
1
20.23
4
4,5-Dihydro-8,9-dehydrotheaspirone
208.30
2.5
0
2
26.3
0
7,24-Stigmastadien-3beta-ol
412.70
8.9
1
1
20.23
5
Campest-7-en-beta-ol
398.70
8.1
0
1
17.07
5
Cyanidin 3-(caffeoyl-sophoroside) 5-glucoside
935.80
15
23
396.43
14
Cyanidin 3-dicaffeoyl-sophoroside 5-glucoside
1097.90
16
26
442.96
18
Rothin B
264.32
1.1
2
4
66.76
0
Kaempferol 7-O-beta-D-glucoside-O-alpha-L-rhamnosyl
594.50
-0.4
9
15
249.2
6
Cyanidin 3-glucosyl-rutinoside
757.70
13
19
329.67
9
(+)-1,2-Epoxyneomenthyl acetate
212.28
2.2
0
3
38.83
3
(+)-8-Acetoxycarvone
208.25
1.9
0
3
43.37
3
p-Menthan-trans-2,5-diol
172.26
1.9
2
2
40.46
1
(1S,6R,7R,8S)-1-methyl-3-methylidene-8-propan-2-yltricyclo[4.4.0.02,7]decane
204.35
4.7
0
0
0
1
5alpha-Stigmasta-7,22,25-trien-3beta-ol
410.70
8.4
1
1
20.23
5
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