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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
Albine
|
232.32
|
1.3
|
1
|
3
|
32.34
|
2
|
|
|
2,5-Dimethyl-2,4-hexadiene
|
110.20
|
3.6
|
0
|
0
|
0
|
1
|
|
|
Cholest-4-ene-3b,6a-diol
|
402.70
|
7.3
|
2
|
2
|
40.46
|
5
|
|
|
2-[6,7-Dihydroxy-5-(hydroxymethyl)-1-benzofuran-4-yl]-6-[2-[6,7-dihydroxy-5-(hydroxymethyl)-1-benzofuran-4-yl]-5,9-dihydroxy-4-oxobenzo[h]chromen-6-yl]-5,9-dihydroxybenzo[h]chromen-4-one
|
810.70
|
7
|
10
|
16
|
289
|
5
|
|
|
(4S,4aR,6S,6aS,6aS,6bR,8aR,11R,12S,12aR,14aS,14bR)-4,4a,6a,6b,8a,11,12,14a-octamethyl-2,3,4,5,6,6a,7,8,9,10,11,12,12a,13,14,14b-hexadecahydro-1H-picen-6-ol
|
428.70
|
10.1
|
1
|
1
|
20.23
|
0
|
|
|
Pent-2-enal
|
84.12
|
1
|
0
|
1
|
17.07
|
2
|
|
|
2-(3-Hydroxyphenyl)-3-methoxyfuro[2,3-h]chromen-4-one
|
308.30
|
3.4
|
1
|
5
|
72.81
|
2
|
|
|
(9R,9aR)-3,5,5,9-tetramethyl-1,6,7,8,9,9a-hexahydrobenzo[7]annulene
|
204.35
|
4.8
|
0
|
0
|
0
|
0
|
|
|
2-(Vinyloxy)ethanol
|
88.11
|
0.1
|
1
|
2
|
29.46
|
3
|
|
|
1-Decyne
|
138.25
|
4.6
|
0
|
0
|
0
|
6
|
|
|
Hortensin
|
314.29
|
2.6
|
2
|
6
|
89.13
|
3
|
|
|
[1,3]Dioxolo[4,5-g]isoquinolin-5(6H)-one
|
189.17
|
1.1
|
1
|
3
|
51.32
|
0
|
|
|
Doryanin
|
203.19
|
1.3
|
0
|
3
|
40.46
|
0
|
|
|
2-Methyl-4-oxo-4H-chromene-8-carboxylic Acid
|
204.18
|
1.4
|
1
|
4
|
67.51
|
1
|
|
|
2-(Hydroxymethyl)-6-methylpiperidine-3,5-diol
|
161.20
|
-0.9
|
4
|
4
|
72.72
|
1
|
|
|
Pyridine, 3-(1-propenyl)-
|
119.16
|
1.7
|
0
|
1
|
12.89
|
1
|
|
|
Ginsenoside La
|
769.00
|
3.5
|
8
|
13
|
207.99
|
7
|
|
|
1-Eicosyne
|
278.50
|
10
|
0
|
0
|
0
|
16
|
|
|
Isochavicinic acid
|
218.20
|
2.7
|
1
|
4
|
55.76
|
3
|
|
|
4,6,6-Trimethyl-5-oxocyclohexa-1,3-diene-1-carbaldehyde
|
164.20
|
1.5
|
0
|
2
|
34.14
|
1
|
|
|
Trideca-3,5,7,9,11-pentayn-2-one
|
178.19
|
2.5
|
0
|
1
|
17.07
|
4
|
|
|
5-Hydroxy-8-methoxy-2-methyl-4h-chromen-4-one
|
206.19
|
2.1
|
1
|
4
|
59.67
|
1
|
|
|
1,6-Dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carbaldehyde
|
198.22
|
-0.2
|
2
|
4
|
66.76
|
1
|
|
|
3-Ethyl-4-methoxyindole
|
175.23
|
2.9
|
1
|
1
|
25.02
|
2
|
|
|
Asimicin
|
622.90
|
9.7
|
3
|
7
|
105.45
|
25
|
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