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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(1R,2R,3S,10S,13S,15R)-3-hydroxy-15-methyl-6-azatetracyclo[8.6.0.01,6.02,13]hexadecan-11-one
|
263.37
|
1.6
|
1
|
3
|
40.54
|
0
|
|
|
Dendocarbin F
|
264.32
|
2.3
|
1
|
4
|
63.6
|
1
|
|
|
Dendocarbin D
|
268.35
|
2.8
|
2
|
4
|
66.76
|
0
|
|
|
gamma-Glutamylphenylalanine
|
294.30
|
-3
|
4
|
6
|
129.72
|
8
|
|
|
(2E,4E)-1-(Piperidin-1-yl)tetradeca-2,4-dien-1-one
|
291.50
|
6.3
|
0
|
1
|
20.31
|
10
|
|
|
Stemofuran F
|
298.30
|
4.3
|
2
|
4
|
62.83
|
2
|
|
|
cespitularin G
|
300.40
|
3.3
|
1
|
2
|
37.3
|
0
|
|
|
5-[5-hydroxy-7-[(E)-3-methylbut-1-enyl]-1-benzofuran-2-yl]benzene-1,3-diol
|
310.30
|
4.7
|
3
|
4
|
73.83
|
3
|
|
|
(1R,2R,4As,8aS)-1-[(3S)-5-hydroxy-3-methylpentyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol
|
310.50
|
5.4
|
2
|
2
|
40.46
|
5
|
|
|
(2R,3R,4S,5S,6R)-2-[(2E,8E)-10-hydroxydeca-2,8-dien-4,6-diynoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
324.32
|
-1.1
|
5
|
7
|
119.61
|
6
|
|
|
Vrtpfkplzcefkf-uhfffaoysa-
|
330.29
|
2.7
|
3
|
7
|
113.29
|
2
|
|
|
(2S,3S,5Z,8S)-8-[(1R)-1-bromopropyl]-3-chloro-2-[(E)-pent-2-en-4-ynyl]-3,4,7,8-tetrahydro-2H-oxocine
|
331.67
|
5
|
0
|
1
|
9.23
|
4
|
|
|
Talcarpine
|
338.40
|
2.2
|
0
|
3
|
34.47
|
1
|
|
|
5,6-Dimethoxy-2-(3,4-dimethoxyphenyl)-1h-quinolin-4-one
|
341.40
|
3.1
|
1
|
6
|
69.78
|
5
|
|
|
Stemocurtisine
|
347.40
|
1.9
|
0
|
6
|
57.23
|
1
|
|
|
3,5-Dihydroxy-1,7-bis(3,4-dihydroxyphenyl)heptane
|
348.40
|
2.6
|
6
|
6
|
121.38
|
8
|
|
|
(5R)-5-[(4-methoxy-1,3-benzodioxol-5-yl)methyl]-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline
|
355.40
|
3.4
|
0
|
6
|
49.39
|
3
|
|
|
(2S,3R,4R,5R,6S)-2-[2-[(2R,4aR)-4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl]propan-2-yloxy]-6-methyloxane-3,4,5-triol
|
368.50
|
2.3
|
3
|
5
|
79.15
|
3
|
|
|
Humantenirine
|
370.40
|
1.2
|
1
|
5
|
60.03
|
2
|
|
|
5,6-Dimethoxy-2-(2',5',6'-trimethoxyphenyl)-1h-quinolin-4-one
|
371.40
|
3
|
1
|
7
|
79.01
|
6
|
|
|
4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl beta-D-glucopyranoside
|
373.31
|
-1.6
|
5
|
10
|
158.38
|
4
|
|
|
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(2R)-4-[(4R)-4-hydroxy-2,6,6-trimethylcyclohexen-1-yl]butan-2-yl]oxyoxane-3,4,5-triol
|
374.50
|
0.2
|
5
|
7
|
119.61
|
6
|
|
|
(2S,10S)-6-methoxy-17,17-dimethyl-5-(3-methylbut-2-enyl)-3,12,16-trioxapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),4(9),5,7,14,18,20-heptaen-10-ol
|
420.50
|
4.7
|
1
|
5
|
57.15
|
3
|
|
|
11alpha-Hydroxyandrosta-1,4-diene-3,17-dione
|
300.40
|
2.1
|
1
|
3
|
54.37
|
0
|
|
|
1-Oxo-3beta,23-dihydroxyolean-12-en-28-oic acid
|
486.70
|
5.5
|
3
|
5
|
94.83
|
2
|
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