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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-Methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol
267.32
2.6
2
3
41.49
1
3-[(3S,5R,8R,9S,10S,13R,14S,17R)-14-hydroxy-3-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-dimethoxyoxan-2-yl]oxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
564.70
2.1
3
9
123.91
6
3-[(2S,3R,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
434.30
1
7
11
190.28
4
Azadiradione
450.60
4.8
0
5
73.58
3
17-Epiazadiradione
450.60
4.8
0
5
73.58
3
(13alpha,17alpha)-7alpha-Acetoxy-21,23-epoxy-4,4,8-trimethyl-24-nor-5alpha-chola-1,14,20,22-tetren-3-one
436.60
5.7
0
4
56.51
3
2-(3,4-Dihydroxyphenyl)-7-hydroxy-5-methoxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-4-one
462.40
0.6
6
11
179.28
4
(-)-Bilobalide from ginkgo leaves
326.30
-0.3
2
8
119.36
1
(S)-Bilobanone
232.32
3.4
0
2
30.21
3
Bipindogenin
406.50
1.6
4
6
107.22
1
(1S,2R,5S,7S)-2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undec-8-en-4-one
218.33
3
0
1
17.07
0
(1S,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.3.1.01,5]undecan-4-one
218.33
3.2
0
1
17.07
0
2-[2-(6-methoxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl)propyl]-4-methyl-2H-furan-5-one
468.70
8.6
0
3
35.53
4
1-Phenyl-1-butene
132.20
3.6
0
0
0
2
CID 12308806
385.60
4.7
1
3
40.54
2
6-(Dimethylamino)-15-[1-(dimethylamino)ethyl]-7-(hydroxymethyl)-7,12,16-trimethylpentacyclo[9.7.0.01,3.03,8.012,16]octadec-9-en-14-ol
444.70
4.5
2
4
46.94
4
Cycloprotobuxin-D
386.70
6.6
2
2
24.06
3
(-)-Cyperene
204.35
4.3
0
0
0
0
(-)-delta-Selinene
204.35
4.3
0
0
0
1
(+)-delta-Selinene
204.35
4.3
0
0
0
1
Cyperenol
220.35
3.1
1
1
20.23
1
(1aR,3aR,4R,7R,8aS)-1a,4,9,9-Tetramethyloctahydro-3a,7-methanoazuleno[1,8a-b]oxirene
220.35
3.8
0
1
12.53
0
Methyl 7-ethyl-5-methyl-10-oxo-5,12-diazatetracyclo[9.7.0.03,8.013,18]octadeca-1(11),13,15,17-tetraene-3-carboxylate
354.40
3
1
4
62.4
3
20-epi-Evatamine
354.40
3
1
4
62.4
3
Erysimoside
696.80
-1.3
7
14
221.9
7
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