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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
(2E,6E)-3,7,11-trimethyl-10-tritiododeca-2,6,10-trienal
222.36
4.9
0
1
17.07
7
Himachalane-2-en-6-ol
222.37
3.8
1
1
20.23
0
(6S,9S)-vomifoliol
224.30
0.5
2
3
57.53
2
7-methoxy-9H-carbazole-3-carbaldehyde
225.24
2.8
1
2
42.09
2
7-epi-Deoxynupharidine
233.35
3.5
0
2
16.38
1
Isodrimenediol
238.37
2.6
2
2
40.46
1
(7S,10aR)-7-pentyl-1,4,5,7,8,9,10,10a-octahydropyrido[1,2-d][1,4]oxazepin-2-one
239.35
3.2
0
3
29.54
4
Benzene, 1,3-dimethoxy-5-(2-phenylethyl)-
242.31
4.1
0
2
18.46
5
11-Methoxyquindoline
248.28
3.3
1
2
37.91
1
2-(2-Hydroxypropan-2-yl)benzo[g][1]benzofuran-4,5-dione
256.25
1.5
1
4
67.51
1
methyl (3R,3aR,7R,7aS)-6-ethenyl-3,7,7a-trimethyl-4-oxo-1,2,3,7-tetrahydroindene-3a-carboxylate
262.34
3.4
0
3
43.37
3
12-Methoxy-1,2,8,9-tetrahydroindolo[7a,1-a]isoquinolin-6-one
267.32
2.1
0
2
29.54
1
Pyridoxine
169.18
-0.8
3
4
73.58
2
2-O-methylisohemigossylic acid lactone
272.29
4.3
1
4
55.76
2
1-Heptadecene-4,6-diyne-3,9,10-triol
278.40
3.5
3
3
60.69
10
13-phenyltridecanoic Acid
290.40
6.8
1
2
37.3
13
9-methoxy-2,2,8-trimethyl-11H-pyrano[2,3-a]carbazole
293.40
4.6
1
2
34.25
1
Acerogenin L
296.40
4
1
3
46.53
0
Vertilecanin C
298.29
1.7
1
5
85.36
6
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(E)-3-methylsulfonylprop-2-enoxy]oxane-3,4,5-triol
298.31
-2.7
4
8
141.9
5
Isoazitine
299.40
2.8
1
2
32.59
0
Glabrocoumarone A
308.30
4.2
2
4
62.83
1
5,6,7-Trihydroxy-3-(3-hydroxy-4-methoxyphenyl)chromen-4-one
316.26
2.3
4
7
120.36
2
11,14-Dihydroxy-8,11,13-abietatrien-7-one
316.40
5.8
2
3
57.53
1
4-[(E,3S,5S)-5-ethoxy-3-hydroxy-7-phenylhept-6-enyl]phenol
326.40
4.3
2
3
49.69
9
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