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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
Acrimarine H
513.50
6.3
2
8
111.13
5
(E)-3-methoxy-1-(4-methoxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one
308.30
3.8
0
4
48.67
5
methyl (3S,11S)-3,11-dihydroxyhexadecanoate
302.40
4.2
2
4
66.76
15
(-)-5'-Desmethylyatein
386.40
3.4
1
7
83.45
6
2-Dodecyltetradecanoic acid
396.70
11.9
1
2
37.3
23
[6,7,8,11,12,13,22-Heptahydroxy-3,16-dioxo-21-(3,4,5-trihydroxybenzoyl)oxy-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4,6,8,10,12,14-hexaen-23-yl] 7,8,9-trihydroxy-3,5-dioxo-1,2-dihydrocyclopenta[c]isochromene-1-carboxylate
908.60
0.4
13
25
424.7
6
2-(4-Hydroxyphenyl)ethyl 4-methoxybenzoate
272.29
3.6
1
4
55.76
6
(8R,8'R)-Secoisolariciresinol 9-glucoside
524.60
0.9
7
11
178.53
12
(2R,3R,4S,5S,6R)-2-[(2S,3S)-4-hydroxy-2,3-bis[(4-hydroxy-3-methoxyphenyl)methyl]butoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
524.60
0.9
7
11
178.53
12
3-[3,5-Dihydroxy-6-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-7-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-4-one
756.70
-2.2
12
20
328.35
9
Derrone
336.30
3.9
2
5
79.9
1
Villosinol
426.40
3.6
2
8
103.68
3
Erythynone
424.40
3.7
0
7
72.45
3
(+)-12a-Hydroxyerythynone
440.40
3
1
8
92.68
3
Methyl 3-(6-hydroxy-7-methoxy-1-benzofuran-5-yl)propanoate
250.25
2
1
5
68.9
5
Casuarinondiol
328.40
2
4
5
97.99
0
(9R,11R)-tricyclo[12.3.1.12,6]nonadeca-1(17),2,4,6(19),14(18),15-hexaene-3,9,11,17-tetrol
314.40
3
4
4
80.92
0
Phenylethyl primeveroside
416.40
-2.2
6
10
158.3
7
2-ethenyl-5-[5-[(E)-prop-1-enyl]thiophen-2-yl]thiophene
232.40
4.8
0
2
56.48
3
Rhamnocitrin 3-glucoside
462.40
1
6
11
179.28
5
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-3-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
462.40
1
6
11
179.28
5
Rhamnetin 3-glucoside
478.40
0.7
7
12
199.51
5
2-(1-Methylethenyl)-5-benzofurancarboxylic acid
202.21
3.3
1
3
50.44
2
Tephrosol
326.26
2.9
1
7
91.27
1
Euchrenone b6
422.50
4.5
3
6
100.13
4
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