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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
Tris(2,4-ditert-butylphenyl)phosphate
662.90
15
0
4
54.57
12
Proline
115.13
-2.5
2
3
49.33
1
Eicosyl trifluoroacetate
394.60
11
0
5
26.3
20
Glucohesperalin
465.60
-1.2
5
13
236.07
12
9-Azabicyclo[3.3.1]nonan-3-one
139.19
0.2
1
2
29.1
0
Homomoschatoline
321.30
3.5
0
5
57.65
3
Tetramethoxychalcone
328.40
3.6
0
5
53.99
7
Guaiacylglycerol
214.21
-0.6
4
5
90.15
4
D-glutamine
146.14
-3.1
3
4
106.41
4
Methyl 10-methylene-9-oxooctadecanoate
324.50
6.7
0
3
43.37
17
Methyl 9-methylene-8-oxoheptadecanoate
310.50
6.1
0
3
43.37
16
CID 14583168
380.40
-1.9
5
8
144.52
1
Gibberellin A75
380.40
-1.9
5
8
144.52
1
5,7,13-Trihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid
364.40
-0.9
4
7
124.29
1
Gibberellin A76
364.40
-0.9
4
7
124.29
1
4-Methyl-2(5H)-furanone
98.10
0.1
0
2
26.3
0
Spiranthesol
618.80
9.8
4
6
99.38
7
Oovavljiumkkqs-uhfffaoysa-
324.40
3.7
1
4
63.6
3
2-(2-Hydroxypropan-2-yl)-7-methoxy-2,3,4,5-tetrahydronaphtho[2,1-e][1]benzofuran-9-ol
326.40
3.5
2
4
58.92
2
7-[(4-Hydroxyphenyl)methyl]-8-methoxy-2,2-dimethyl-3,4,5,6-tetrahydronaphtho[2,1-f]chromen-10-ol
416.50
6
2
4
58.92
3
Plumerinine
225.37
3.3
1
2
23.47
1
(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
398.70
9
0
1
17.07
5
Stigmast-24(28)-en-3-one, (5alpha)-
412.70
9.3
0
1
17.07
5
1-[(7-Hydroxy-4-methoxy-9,10-dihydrophenanthren-2-yl)oxy]-4-methoxy-9,10-dihydrophenanthrene-2,7-diol
482.50
6.2
3
6
88.38
4
1-[(5-Hydroxy-7-methoxy-9,10-dihydrophenanthren-2-yl)oxy]-4-methoxy-9,10-dihydrophenanthrene-2,7-diol
482.50
6.2
3
6
88.38
4
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