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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
Impressic Acid
472.70
6.9
3
4
77.76
2
[(3S,4R,5R)-5-(3,4-dimethoxyphenyl)-4-(hydroxymethyl)oxolan-3-yl]-(3,4,5-trimethoxyphenyl)methanone
432.50
2.2
1
8
92.68
9
Pseudouridine
244.20
-2.8
5
6
135.64
2
25-Methylheptacosanoic acid
424.70
13.3
1
2
37.3
25
[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
340.32
-0.3
4
8
125.68
6
Stigmasteryl ferulate
588.90
10.8
1
4
55.76
10
Campesteryl ferulate
576.80
11.1
1
4
55.76
10
4,7-Dihydroxy-2,3-dimethoxy phenanthrene
270.28
3.7
2
4
58.92
2
Licofuranone
356.40
4
3
6
96.22
4
Parsonsine
439.50
1
2
9
122.6
2
(1R,4S,8R,9S,19R)-9-ethyl-4,9-dihydroxy-8-methyl-4-propan-2-yl-2,7,11-trioxa-16-azatricyclo[11.5.1.016,19]nonadec-13-ene-3,6,10-trione
425.50
0.5
2
9
122.6
2
3,3,8-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol
279.30
4.3
2
2
45.25
0
9-methoxy-3,3,8-trimethyl-11H-pyrano[3,2-a]carbazole
293.40
4.6
1
2
34.25
1
9-methoxy-3,8-dimethyl-3-(4-methylpent-3-enyl)-11H-pyrano[3,2-a]carbazole
361.50
6.6
1
2
34.25
4
Euchrestine-A
281.30
5
3
2
56.25
2
Euchrestine B
363.50
7.2
2
2
45.25
6
2-ammonioethyl (2R)-2,3-bis(stearoyloxy)propyl phosphate
748.10
14.6
1
8
148.64
43
3,3-bis(3-methylbut-2-enyl)-2H-naphthalene-1,4-dione
296.40
4.9
0
2
34.14
4
2,3-Dimethyl-6-geranyl-1,4-benzoquinone
272.40
5.2
0
2
34.14
5
3-Vinyl-4H-1,2-dithiin
144.30
2.1
0
2
50.6
1
2'-Hydroxy-5'-methylacetophenone
150.17
2.3
1
2
37.3
1
(5S,8'R)-8'-hydroxy-6-methylspiro[7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline-5,7'-8H-cyclopenta[g][1,3]benzodioxole]-6'-one
367.40
1.9
1
7
77.46
0
[(2S,3R,4R)-2-(1,3-benzodioxol-5-yl)-4-(1,3-benzodioxol-5-ylmethyl)oxolan-3-yl]methyl acetate
398.40
3.4
0
7
72.45
6
(2Z)-2-[(3,4-dihydroxyphenyl)methylidene]-6-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzofuran-3-one
448.40
0.4
7
11
186.37
4
[(2R,3S,4S,5R,6S)-6-[[(2Z)-2-[(3,4-dihydroxyphenyl)methylidene]-7-hydroxy-3-oxo-1-benzofuran-6-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
594.50
2.1
7
13
212.67
8
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