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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
5,10-Dihydroxy-8-methoxy-2-propylbenzo[h]chromen-4-one
300.30
3.8
2
5
79.9
3
8-(2-Hydroperoxy-3-methylbut-3-enyl)-7-methoxychromen-2-one
276.28
2.8
1
5
68.9
5
7-Methoxy-8-(3-methylbuta-1,3-dien-1-yl)-2H-chromen-2-one
242.27
3.9
0
3
39.44
3
cis-Dehydroosthol
242.27
3.9
0
3
39.44
3
[(1R,2R)-1-hydroxy-1-(7-methoxy-2-oxochromen-8-yl)-3-methylbut-3-en-2-yl] acetate
318.32
2.2
1
6
85.97
6
[(1R,2S)-1-hydroxy-1-(7-methoxy-2-oxochromen-8-yl)-3-methylbut-3-en-2-yl] acetate
318.32
2.2
1
6
85.97
6
CID 13917405
258.27
2.6
0
4
51.97
3
(7-Methoxy-8-(1,2-dihydroxy-3-methyl-3-butenyl))coumarin
276.28
1.6
2
5
79.9
4
7-Methoxy-8-[(E)-3-oxo-1-butenyl]-2H-1-benzopyran-2-one
244.24
2
0
4
56.51
3
7-methoxy-8-[(Z)-3-oxobut-1-enyl]chromen-2-one
244.24
2
0
4
56.51
3
[(2S)-3-hydroxy-1-(7-methoxy-2-oxochromen-8-yl)-3-methylbutan-2-yl] 3-methylbutanoate
362.40
3.3
1
6
85.97
8
5-Hydroxy-7-methoxy-8-prenyl-coumarin
260.28
3.5
1
4
59.67
3
[1-(7-Methoxy-2-oxochromen-8-yl)-3-methyl-2-oxobutyl] 3-methylbut-2-enoate
358.40
4
0
6
82.81
7
(3,4,5,11,12,21,22,23-Octahydroxy-8,18-dioxo-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaen-13-yl) 3,4,5-trihydroxybenzoate
634.50
0.1
11
18
310.66
3
Sanguiin H4
634.50
0.6
11
18
310.66
4
Isostrictinin
634.50
0.6
11
18
310.66
4
[(10R,11R,13R,14R,15S)-3,4,5,14,20,21,22-heptahydroxy-13-(hydroxymethyl)-8,17-dioxo-9,12,16-trioxatetracyclo[16.4.0.02,7.010,15]docosa-1(22),2,4,6,18,20-hexaen-11-yl] 3,4,5-trihydroxybenzoate
634.50
0.6
11
18
310.66
4
CID 13917529
610.50
2.1
8
14
236.81
8
(3R,3aS,6R,6aS,10aS)-3,6,9-trimethyl-3,3a,4,5,6,6a,7,8-octahydrobenzo[h][1]benzofuran-2-one
234.33
3.2
0
2
26.3
0
3,6,9-Trimethyl-3,3a,4,5,6,6a,7,8-octahydrobenzo[h][1]benzofuran-2-one
234.33
3.2
0
2
26.3
0
Euonine
805.80
0.5
1
19
252.75
13
methyl (1R,4aR,4bR,7R,9R,10aR)-7-ethenyl-9-hydroxy-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
332.50
4.6
1
3
46.53
3
(1S,3R,8R,11S,12S,15R,16R)-15-[(2R,5R)-5,6-dimethylhept-6-en-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
438.70
10.1
0
1
17.07
5
Armexifolin
262.30
0.8
1
4
63.6
0
[(3aR,4S,9aS,9bR)-6,9-dimethyl-3-methylidene-2,7-dioxo-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-4-yl] acetate
302.32
1.1
0
5
69.67
2
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