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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
(2s)-2-phenylpropionyl 6-O-beta-d-xylopyranosyl-beta-d-glucopyranoside
444.40
-1.9
6
11
175.37
7
p-Methoxy-cis-cinnamoyl dopamine
313.30
2.7
3
4
78.79
6
Desmethylisoophiopogonone B
298.29
3.3
3
5
90.9
2
Bicyclo[7.2.0]undec-4-ene
150.26
4.4
0
0
0
0
cis-Hexenyl tiglate
182.26
3.6
0
2
26.3
6
(e)-4-(3,4-Dimethoxyphenyl)but-3-en-1-yl linoleate
470.70
9.4
0
4
44.76
21
(e)-4-(3,4-Dimethoxyphenyl)but-3-en-1-yl oleate
472.70
10.1
0
4
44.76
22
Nonadecatrienylresorcinol
370.60
9.9
2
2
40.46
15
Pentacosenylresorcinol
458.80
14
2
2
40.46
23
Heneicosatrienylresorcinol
398.60
11
2
2
40.46
17
Tricosadienylresorcinol
428.70
12.5
2
2
40.46
20
17,20,23-Hexacosatrienol
376.70
10.4
1
1
20.23
21
17,20-Hexacosadienol
378.70
11.1
1
1
20.23
22
15,18-Tetracosadienol
350.60
10
1
1
20.23
20
13,16,19-Docosatrienol
320.60
8.2
1
1
20.23
17
15,18,21-Tetracosatrienol
348.60
9.3
1
1
20.23
19
Methyl oxo(2,4,6-trihydroxyphenyl)acetate
212.16
1.1
3
6
104.06
3
(5r)-5-Hydroxy-1-(3,4-dihydroxy phenyl)-7-(4-hydroxy-3-methoxyphenyl)-3-heptanone
360.40
2.4
4
6
107.22
9
Campestanyl palmitate
641.10
18
0
2
26.3
22
(2r,3r,4s,5s,6s)-Heptane-1,2,3,4,5,6-hexaol
196.20
-2.7
6
6
121.38
5
4alpha-Methyl-5alpha-stigmast-7-en-3beta-ol
428.70
9.5
1
1
20.23
6
(12-Ricinoleoylricinoleoyl)-diricinoleoyl-glycerol
1213.90
20.9
7
11
209.89
66
(r)-2-Butyl-1-propenyl disulphide
258.50
6.6
0
2
50.6
9
9,10-Dihydro-5,6,8-trimethoxy-3,4-phenanthrenediol
302.32
3
2
5
68.15
3
9,10-Dihydro-2,7-dihydroxy-1,3,5-trimethoxyphenanthrene
302.32
3
2
5
68.15
3
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