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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
Iscag
610.50
-1.1
10
16
269.43
7
Bianfugecine
291.30
3.2
0
4
48.42
2
14beta-Hydroxygelsedine
344.40
0.9
2
5
71.03
2
[(2R)-3-[hydroxy-[2-(methylamino)ethoxy]phosphoryl]oxy-2-octadec-9-enoyloxypropyl] octadec-9-enoate
758.10
11.1
2
9
130.2
42
Infusamine
379.73
-0.9
3
8
146.09
5
Ectoine
142.16
-0.8
2
3
61.69
1
Tanshinol B
296.30
2.2
1
4
67.51
0
Tanshindiol C
312.30
1.2
2
5
87.74
0
4-[(3R)-3-(4-Hydroxyphenyl)penta-1,4-dienyl]phenol
252.31
4.4
2
2
40.46
4
Bornenol
152.23
2.7
1
1
20.23
0
(2S,4S)-2-amino-4-methylhexanoic acid
145.20
-1
2
3
63.32
4
8-Isopropyl-5-methyl-4,4A,5,6,7,8-hexahydronaphthalen-2(3H)-one
206.32
3.3
0
1
17.07
1
Isoamyl isovalerate
172.26
3.1
0
2
26.3
6
Puqiedinone
413.60
5.3
1
3
40.54
0
(S)-Hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
154.17
-0.6
1
2
49.41
0
Guanidinooxypropylamine
132.16
-1.4
3
3
99.65
4
2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethenyl)-, trans-
152.23
2.4
1
1
20.23
1
Ethyl 1-allylcyclopropanecarboxylate
154.21
1.9
0
2
26.3
5
Docosanol
326.60
10.5
1
1
20.23
20
9-Deoxygoniopypyrone
234.25
0.9
1
4
55.76
1
Methyl 3-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]prop-2-enoate
246.30
3.8
1
3
46.53
5
(3r)-8-[(2r,3s)-3-Heptyloxiran-2-yl]oct-1-ene-4,6-diyn-3-ol
260.40
4.5
1
2
32.76
9
4-Hydroxy-3,5-diprenylcinnamic acid
300.40
5.4
2
3
57.53
6
Ephedradine A
492.60
1.5
4
6
102.93
1
4',6-Dichloroflavan
279.20
5.1
0
1
9.23
1
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