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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
(Z)-Akuammidine
352.40
1.5
2
4
65.56
3
16-Epivoacarpine
368.40
0.7
3
5
85.79
3
cyclohexyl 3-(1H-indol-3-yl)propanoate
271.35
3.9
1
2
42.09
5
(1R)-1-[[3-[5-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxyphenoxy]phenyl]methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinoline
638.80
7
0
8
61.86
11
2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-3-en-1-yl]-5-propylbenzene-1,3-diol
286.40
5.2
2
2
40.46
4
1-Hydroxy-6-methoxy-3-methylanthracene-9,10-dione
268.26
3.4
1
4
63.6
1
1,4-Diethyl-2-methylbenzene
148.24
3.9
0
0
0
2
3-Methylbenzaldehyde dimethyl acetal
166.22
1.9
0
2
18.46
3
2',4',alpha-Trihydroxy-4-methoxydihydrochalcone
288.29
2.8
3
5
86.99
5
2',4',7-Trihydroxyisoflavanone
272.25
2
3
5
86.99
1
rel-(2R,3S)-2-(Benzoyloxy)-3-hydroxybutanedioic acid
254.19
0.3
3
7
121.13
6
1,10-Undecadiene
152.28
5.7
0
0
0
8
[2-[3,5-Dihydroxy-2-[[2-hydroxy-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-yl]oxy]-6-methyloxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] acetate
823.00
3.1
7
14
214.06
8
[2-[3,5-Dihydroxy-2-[[2-hydroxy-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-yl]oxy]-6-methyloxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] acetate
823.00
3.1
7
14
214.06
8
1-Hexen-3-yne
80.13
2.3
0
0
0
0
(2-phenylacetyl)-L-aspartic acid
251.23
0.3
3
5
103.7
6
Botryorhodine G
332.30
2.6
4
7
116.45
1
Boydone A
309.40
3
2
5
75.63
7
Rubasperone A
556.50
6
3
10
148.8
4
5-hydroxy-7-methoxy-4'-O-(3-methylbut-2-enyl) isoflavone
352.40
4.8
1
5
68.9
5
Guignardone I
310.40
0.7
2
5
75.99
2
Furanone A
196.20
1.2
1
4
63.6
4
Mitibetaimol A
234.33
2.8
1
2
37.3
0
Similin B
265.35
3
1
4
69.39
4
Cinnamomin
2358.60
-12.9
38
40
1073.89
77
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