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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
3,3''-Dihydroxyterphenyllin
370.40
3.3
5
7
119.61
4
(1E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hept-1-ene-3,5-dione
370.40
3
2
6
93.06
9
1,2-Diacetoxylycorine
371.40
1.1
0
7
74.3
4
Calycopterin
374.30
3.1
2
8
107.59
5
8-butanoyl-5,7-dihydroxy-4-[(1S)-1-hydroxypropyl]-6-(3-methylbut-2-enyl)chromen-2-one
374.40
3.8
3
6
107.97
7
[(1S,13R,14R,15S,16S)-15-hydroxy-4,5,14-trimethoxy-9-azatetracyclo[7.6.1.02,7.012,16]hexadeca-2,4,6,11-tetraen-13-yl] acetate
375.40
0.1
1
7
77.46
5
2-Methoxy-8-(7-methoxy-2-oxochromen-8-yl)-6-methylnaphthalene-1,4-dione
376.40
3.6
0
6
82.81
3
Isovaleric acid
102.13
1.2
1
2
37.3
2
Thalicpureine
385.50
4.1
1
6
58.18
8
6-Methylheptanal
128.21
2.6
0
1
17.07
5
8-Hydroxy-7-methyl-5-(3,4,5-trimethoxyphenyl)benzo[f][1,3]benzodioxole-6-carboxylic acid
412.40
4.1
2
8
103.68
5
Bisnorstriatol
414.60
9.2
4
4
80.92
15
Vibsanin C
416.50
4.8
1
5
80.67
10
Panepophenanthrin
420.50
-1.4
4
8
132.28
2
Murrastifoline F
420.50
7.1
1
2
39.18
3
Picraquassioside B
428.40
-0.1
5
11
168.28
8
3-Methoxyminimiflorin
436.50
5.6
2
6
85.22
4
Isomallotochromene
442.50
4.2
4
8
133.52
5
(2S)-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(5-hydroxy-5-methyl-2-prop-1-en-2-ylhexyl)-2,3-dihydrochromen-4-one
442.50
4.5
5
7
127.45
7
Leucosceptrine
448.50
2.1
3
7
113.29
5
Epipachysamine D
450.70
7.6
1
2
32.34
4
3-Epikatonic acid
456.70
7.5
2
3
57.53
1
Larreantin
460.50
4.8
2
7
102.29
6
(6S)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),2,13,15(19)-tetraen-4-one
461.50
-0.5
4
10
138.15
3
3,5,6-trihydroxy-2-(4-hydroxyphenyl)-7-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
464.40
0.4
8
12
210.51
4
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