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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Speciogynine
|
398.50
|
3.4
|
1
|
5
|
63.79
|
6
|
|
|
methyl (Z)-2-[(2S,3S,12bS)-3-ethyl-8-methoxy-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate
|
398.50
|
3.4
|
1
|
5
|
63.79
|
6
|
|
|
Monoginol A
|
444.70
|
8.4
|
2
|
2
|
40.46
|
1
|
|
|
1-Stearoyl-sn-glycerol
|
358.60
|
7.4
|
2
|
4
|
66.76
|
20
|
|
|
3-Stearoyl-sn-glycerol
|
358.60
|
7.4
|
2
|
4
|
66.76
|
20
|
|
|
Mopanin
|
298.25
|
1.9
|
3
|
6
|
100.13
|
0
|
|
|
CID 15560614
|
302.28
|
0.8
|
4
|
6
|
99.38
|
0
|
|
|
17beta(H),21beta(H)-HOP-22(29)-EN-3-ONE
|
424.70
|
9.6
|
0
|
1
|
17.07
|
1
|
|
|
Quinoline-3-carboxamide
|
172.18
|
1.1
|
1
|
2
|
55.98
|
1
|
|
|
alpha-Linolenoyl phenylethylamine
|
381.60
|
7.6
|
1
|
1
|
29.1
|
16
|
|
|
P-Mentha-2,8-dien-1-ol
|
152.23
|
2.4
|
1
|
1
|
20.23
|
1
|
|
|
Steporphine
|
295.30
|
2.2
|
1
|
4
|
41.93
|
0
|
|
|
(4R)-4-hydroxy-5,5-dimethyloxolan-2-one
|
130.14
|
-0.2
|
1
|
3
|
46.53
|
0
|
|
|
9-((3,7-Dimethylocta-2,6-dien-1-yl)oxy)-7H-furo[3,2-g]chromen-7-one
|
338.40
|
5.3
|
0
|
4
|
52.58
|
6
|
|
|
4-[(2S,3S)-3-tetradeca-1,3,5,8-tetraenyloxiran-2-yl]butanoic acid
|
318.40
|
5.3
|
1
|
3
|
49.83
|
13
|
|
|
Spinosin
|
608.50
|
-1.1
|
9
|
15
|
249.2
|
7
|
|
|
8-Hydroxyhexadecanoic acid
|
272.42
|
5.4
|
2
|
3
|
57.53
|
14
|
|
|
(8R)-8-hydroxyhexadecanoic acid
|
272.42
|
5.4
|
2
|
3
|
57.53
|
14
|
|
|
(R)-beta-hydroxypalmitic acid
|
272.42
|
5.8
|
2
|
3
|
57.53
|
14
|
|
|
2,5-Dihydrofuran
|
70.09
|
0.5
|
0
|
1
|
9.23
|
0
|
|
|
(3S,7S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2S)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
|
402.70
|
7.4
|
2
|
2
|
40.46
|
5
|
|
|
Diacetoxyscirpenol
|
366.40
|
0.2
|
1
|
7
|
94.59
|
5
|
|
|
Scirpene-3,4,15-triol
|
282.33
|
-1
|
3
|
5
|
82.45
|
1
|
|
|
11-Hydroxytephrosin
|
426.40
|
3.2
|
2
|
8
|
103.68
|
2
|
|
|
4-Hydroxy-9h-pyrido[3,4-b]indole-1-carboxylic acid methyl ester
|
242.23
|
2.1
|
2
|
4
|
75.21
|
2
|
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