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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
Citbismine A
640.60
5.6
5
12
172.7
5
Tripoxyrollin
588.90
12.2
0
5
63.89
28
[2-hydroxy-3-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxypropyl] (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
676.80
1.2
8
14
225.06
23
[2-hydroxy-3-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxypropyl] (9Z,12Z)-octadeca-9,12-dienoate
678.80
1.9
8
14
225.06
24
[2-hydroxy-3-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxypropyl] (Z)-octadec-9-enoate
680.80
2.6
8
14
225.06
25
Kanzonol R
370.40
4.8
2
5
68.15
5
Kanzonol N
384.40
4.5
3
6
96.22
5
Kanzonol M
398.40
4.8
2
6
85.22
6
Kanzonol O
382.40
3.9
2
6
85.22
3
Kanzonol L
488.60
7.4
3
6
100.13
5
Artonin Q
530.60
5.9
2
8
123.27
5
Artonin R
562.60
4.4
3
10
152.73
6
1,2,2'-Trisinapoylgentiobioside
960.90
2
8
23
323.81
22
Stigmastanol ferulate
592.90
12.4
1
4
55.76
11
Acutoside C
1207.30
-1.4
15
26
412.82
13
Cyanidin 3-(6-feruloylglucoside) 5-(6-malonylglucoside)
873.70
11
21
349.65
16
Cyanidin 3-(6-coumaryl-2'-sinapoylsophoroside) 5-glucoside
1126.00
14
26
420.96
20
Cyanidin 3-O-[b-D-Xylopyranosyl-(1->2)-[4-hydroxycinnamoyl-(->6)-b-D-glucopyranosyl-(1->6)]-b-D-galactopyranoside]
889.80
13
21
355.97
13
Alatanin B
1348.20
17
33
518.57
25
Alatanin A
1510.30
20
38
597.72
28
1-Methoxyphaseollin
352.40
3.5
1
5
57.15
1
Panaxynol linoleate
506.80
12.9
0
2
26.3
25
Helianthoside C
1499.60
-3.4
19
34
530.66
17
Ginsenoyne A linoleate
520.80
11.3
0
3
38.83
25
Panaxydol linoleate
522.80
11.8
0
3
38.83
25
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