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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
Guanosine diphosphate glucose
605.30
-6.2
10
18
351.34
9
Guanine, 9-beta-D-xylofuranosyl-
283.24
-1.9
5
7
159.51
2
beta-Inosine
268.23
-1.3
4
7
133.49
2
Tetrahydrobiopterin
241.25
-1.9
6
6
136.29
2
Tetrahydropteroylglutamate
445.40
-0.6
8
10
211.56
9
Leucopterin
195.14
-2.4
4
4
137.49
0
Hematein
300.26
-0.1
4
6
107.22
0
Rhodocladonic acid
318.23
1.7
3
8
134.27
2
[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate
605.30
-6.2
10
18
351.34
9
Hydroxysesamone
274.27
3.2
3
5
94.83
2
Pheophytin b
885.20
11
2
10
139.01
22
Methyl pheophorbide a
606.70
3.1
2
9
121.94
8
4-Hydroxyquinazoline
146.15
0.7
1
2
45.75
0
Hexahydroxy-2,3-naphthalenedione
254.15
0.8
6
8
155.52
0
5-Formyl-tetrahydrofolate
471.40
0.1
5
10
225.5
7
Phaeophytin b
885.20
11
2
10
139.01
22
GDP-L-fucose
589.30
-5.7
9
17
331.11
8
1-Hydroxyphenazine
196.20
2.3
1
3
46.01
0
7-methyl-3-(3,4,5-trihydroxyphenyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,8-dioxatricyclo[7.3.1.05,13]trideca-1(12),3,5(13),6,9-pentaen-11-one
648.60
-2.8
9
16
262.34
6
Brassilexin
174.22
2.8
1
2
56.92
0
Vicine
304.26
-3.7
7
9
197.17
3
3,4-Dehydro-5S-carboxystrictosidine
572.60
0.6
6
12
200.36
9
6-Hydroxymethylpterin
193.16
-2.2
3
5
117.78
1
vitamine B1
337.30
3
6
105.4
4
(7E)-10-hydroxy-7-hydroxyimino-3-methoxy-8,8-dimethyl-2-propan-2-ylphenanthrene-1,4-dione
355.40
4.1
2
6
96.19
2
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