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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
1,5-Diphenylpentan-3-ol
240.34
4.2
1
1
20.23
6
(3aS,5aR,9aS,9bR)-3a,6,6,9a-tetramethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran
236.39
4.7
0
1
9.23
0
1-[(2S)-6-hydroxy-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-5-yl]ethanone
218.25
3.1
1
3
46.53
2
3-(2-Hydroxy-4-methoxy-phenyl)-acrylic acid
194.18
1.5
2
4
66.76
3
Clausenamide
297.30
1.5
2
3
60.77
3
delta-Dodecalactone
198.30
3.6
0
2
26.3
6
2-Hydroxydecanedioic acid
218.25
1.4
3
5
94.83
9
19-Oxotestosterone
302.40
2
1
3
54.37
1
(R)-m-Menth-1(6)-en-8-ol
154.25
1.8
1
1
20.23
1
Anthriscinol methyl ether
222.24
2
0
4
36.92
4
Bicyclo[3.1.1]heptan-3-one
110.15
1.1
0
1
17.07
0
2-Phenylbenzimidazole
194.23
3.2
1
1
28.68
1
Ginsenoside Rc
1079.30
0.9
14
22
357.06
16
CID 12855917
638.90
4.3
7
9
160.07
7
panaxoside A progenin
638.90
4.3
7
9
160.07
7
2-(hydroxymethyl)-6-[6-(hydroxymethyl)-2-[[17-[2-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-6-methyl-hept-5-en-2-yl]-4,4,8,10,14-pentamethyl-3,12-bis(oxidanyl)-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-4,5-b
963.20
1.1
13
19
318.37
13
3,7,11,15-Tetramethyl-2,6,10,14-hexadecatetraenic acid
304.50
6.8
1
2
37.3
10
Aristoloside
519.40
1.4
5
13
207.51
5
4-[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]butan-2-one
194.31
2.8
0
1
17.07
3
Pinocarvyl acetate, trans-(-)-
194.27
2.4
0
2
26.3
2
Dimethylmatairesinol
386.40
3.9
0
6
63.22
8
1,3,5-Triisopropylbenzene
204.35
5.3
0
0
0
3
1-Hydroxy-2,3-dimethoxyanthracene-9,10-dione
284.26
3
1
5
72.83
2
(4aS,6R,7R,7aR)-6-(6-aminopurin-9-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol
329.21
-2.6
3
10
164.65
1
Adlumidiceine
399.40
0.4
1
8
94.53
7
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