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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
beta-Santalic acid
234.33
4
1
2
37.3
4
Psiguavin
1190.80
-0.2
16
31
524.85
0
Psidinin C
1194.90
1.8
18
31
531.17
5
Rofficerone
440.70
7.1
1
2
37.3
0
2-(hydroxymethyl)-6-[[12-hydroxy-4,4,8,10,14-pentamethyl-17-[(2Z)-6-methylhepta-2,5-dien-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-3,4,5-triol
604.90
7
5
7
119.61
6
Ginsenoside M7cd
654.90
3.3
8
10
180.3
8
6-(Hydroxymethyl)-2,6,12-trimethyltetracyclo[11.2.1.01,10.02,7]hexadec-11-en-4-ol
304.50
4
2
2
40.46
1
Physagulin G
722.80
-1.2
7
15
242.27
8
b-D-Glucopyranuronosyl-(1->3)-a-D-galactopyranuronosyl-(1->2)-a-L-rhamnopyranosyl-(1->4)-[b-D-glucopyranuronosyl-(1->3)]-a-D-galactopyranuronosyl-(1->2)-L-rhamnopyranose
1014.80
-9.1
18
33
533.95
14
10-Acetoxy-8-heptadecene-4,6-diyn-3-ol
304.40
4.9
1
3
46.53
11
(all-E)-1,8,10-Heptadecatriene-4,6-diyne-3,12-diol
258.35
3.8
2
2
40.46
8
Isoamericanol
330.30
1.6
4
6
99.38
4
7-Chloro-6-demethylcepharadione B
341.70
3.8
1
4
64.63
2
Psidinin B
1192.90
1.5
18
31
531.17
1
Psidinin A
1192.90
1.5
18
31
531.17
1
Pandamarilactone 31
331.40
2.4
0
5
55.84
5
Pandamarilactone 32
299.40
2.9
0
4
46.61
4
10-Acetylpanaxytriol
320.40
4.1
2
4
66.76
12
(-)-Epicatechin 8-C-galactoside
452.40
-1
9
11
200.53
3
Sativoside R1
1377.50
-4.6
20
33
524.59
21
Cadabicine methyl ether
449.50
3.4
3
5
88.69
1
5-(10-Nonadecenyl)-1,3-benzenediol
374.60
10.3
2
2
40.46
17
5-(10,13-Nonadecadienyl)-1,3-benzenediol
372.60
9.6
2
2
40.46
16
5-(12-Heneicosenyl)-1,3-benzenediol
402.70
11.4
2
2
40.46
19
5-(14-Heneicosenyl)-1,3-benzenediol
402.70
11.4
2
2
40.46
19
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