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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Ardisiphenol C
|
402.60
|
8.3
|
2
|
4
|
66.76
|
16
|
|
|
cis-Myrtanol
|
154.25
|
2.5
|
1
|
1
|
20.23
|
1
|
|
|
4-Cumylphenol
|
212.29
|
3.7
|
1
|
1
|
20.23
|
2
|
|
|
3'-Geranyl-2',3,4,4'-tetrahydroxychalcone
|
408.50
|
6.6
|
4
|
5
|
97.99
|
8
|
|
|
methyl (15R,16R,20R)-6,7-dimethoxy-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4,6,8,18-pentaene-19-carboxylate
|
412.50
|
2.7
|
1
|
6
|
73.02
|
4
|
|
|
(8R,9S)-8-benzyl-5,8,9-trihydroxy-6-methyl-4-phenyl-9H-furo[2,3-h]chromen-2-one
|
416.40
|
3.2
|
3
|
6
|
100.13
|
3
|
|
|
(2R,3R,4S,5S,6R)-2-[[(1S,1aR,3aR,4S,7R,7aS,7bS)-4-hydroxy-1-(hydroxymethyl)-1,7-dimethyl-2,3,3a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[a]naphthalen-4-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
416.50
|
-0.1
|
6
|
8
|
139.84
|
5
|
|
|
Cimicifugic acid D
|
418.30
|
1.5
|
6
|
10
|
181.82
|
9
|
|
|
4,5,14,15,16-Pentamethoxy-9,10-dimethyltricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaene-3,10-diol
|
418.50
|
3.7
|
2
|
7
|
86.61
|
5
|
|
|
Cyclomulberrin
|
420.50
|
5.8
|
3
|
6
|
100.13
|
3
|
|
|
(2s,3s)-2,3-Bis[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-1,4-butanediol
|
422.50
|
2.5
|
4
|
8
|
117.84
|
11
|
|
|
eriosemaone A
|
422.50
|
5.2
|
3
|
6
|
96.22
|
3
|
|
|
Uncinoside B
|
424.40
|
0.2
|
4
|
10
|
155.89
|
5
|
|
|
(21I(2))-Aa(2)-Neogammacer-22(29)-en-3-one
|
424.70
|
9.6
|
0
|
1
|
17.07
|
1
|
|
|
(2R,15R)-14-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-ene-5,8-dione
|
426.70
|
8.4
|
0
|
2
|
34.14
|
6
|
|
|
(6R,8S)-octacosane-6,8-diol
|
426.80
|
12.1
|
2
|
2
|
40.46
|
25
|
|
|
Secasterol
|
430.70
|
6.6
|
2
|
3
|
57.53
|
5
|
|
|
Salireposide
|
406.40
|
0.7
|
5
|
9
|
145.91
|
7
|
|
|
Yadanziolide B
|
442.40
|
-3.9
|
7
|
11
|
194.21
|
1
|
|
|
(1R,3aR,5aS,5bR,7aR,9R,11aR,11bR,13aS,13bR)-5a-(hydroxymethyl)-3a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol
|
442.70
|
8.5
|
2
|
2
|
40.46
|
2
|
|
|
Cubebin
|
356.40
|
3.4
|
1
|
6
|
66.38
|
4
|
|
|
(1S,9R,10R,11R,12R,14R,17S)-5,7-dihydroxy-10,13,13,17-tetramethyl-9-(2-methylpropyl)-2-oxapentacyclo[8.7.2.01,11.03,8.012,14]nonadeca-3,5,7-triene-4,6-dicarbaldehyde
|
454.60
|
7.1
|
2
|
5
|
83.83
|
4
|
|
|
(3S,6R)-6-propylpiperidin-3-ol
|
143.23
|
1
|
2
|
2
|
32.26
|
2
|
|
|
(1S,2R,5R)-2-methyl-5-propan-2-ylbicyclo[3.1.0]hexan-2-ol
|
154.25
|
2.1
|
1
|
1
|
20.23
|
1
|
|
|
Cleroindicin E
|
158.19
|
-0.3
|
2
|
3
|
49.69
|
0
|
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