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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 Beta-D-ribofuranosylpyridin-4-one 3-carboxamide
270.24
-1.6
4
7
135.01
3
(z)-9-Nonacosene
406.80
15
0
0
0
25
(S)-Turmerone
218.33
3.3
0
1
17.07
4
3-Undecyne
152.28
5
0
0
0
5
4-Undecyne
152.28
5
0
0
0
5
(1R,1'S,2'S,5R,6S)-2',3-dibromo-1'-chloro-1',4,4,6-tetramethylspiro[7-oxabicyclo[4.1.0]hept-2-ene-5,4'-cyclohexane]
412.59
4.7
0
1
12.53
0
Chrysoeriol 7-rutinoside
608.50
-0.8
8
15
238.2
7
2-[5-[[(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]oxycarbonyl]-2,3-dihydroxyphenoxy]-3,4,5-trihydroxybenzoic acid
802.60
1
14
23
397.65
7
(2R,3R)-5-hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-[1,4]dioxino[2,3-c]xanthen-7-one
452.40
2.8
3
9
127.82
4
Natsudaidain 3-O-I(2)-D-glucoside
580.50
1.1
4
14
184.97
10
5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-8-methoxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-4-one
492.40
1.2
6
12
188.51
5
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3,6-bis[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-4-one
626.50
-1.4
11
17
289.66
7
6-Hydroxykaempferol 3,6-diglucoside
626.50
-1.4
11
17
289.66
7
Narirutin 4'-glucoside
742.70
-2.9
11
19
304.21
9
5,5-Diisopropyl-2,2'-dimethylbiphenyl-3,3',4,4'-tetrone
326.40
2.5
0
4
68.28
3
Kaempferol 3-(2',6'-di-(E)-p-coumarylglucoside)
740.70
4.8
7
15
242.88
12
1,3,8-Trihydroxy-2-methylanthracene-9,10-dione
270.24
2.7
3
5
94.83
0
1,3,8-Trihydroxy-6-methoxy-2-methylanthracene-9,10-dione
300.26
2.7
3
6
104.06
1
5,6-Dihydroxy-3,3',4',7-tetramethoxyflavone
374.30
3.1
2
8
107.59
5
4'-Hydroxy-3,5,6,7,3'-pentamethoxyflavone
388.40
2.9
1
8
96.59
6
2-(3,4-Dihydroxyphenyl)-3,5,6,7-tetramethoxychromen-4-one
374.30
2.6
2
8
107.59
5
5-Hydroxy-7-methoxy-2-[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
476.40
1.2
5
11
168.28
6
5-hydroxy-7-methoxy-2-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
476.40
1.2
5
11
168.28
6
5-hydroxy-7-methoxy-2-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
654.60
-0.8
9
17
267.66
9
Homoflavoyadorinin B
608.50
-0.1
7
15
227.2
9
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