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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
(1S,3R,8R,11S,12S,15S,16R)-15-(5-hydroxy-6-methylhept-6-en-2-yl)-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol
|
442.70
|
8.6
|
2
|
2
|
40.46
|
5
|
|
|
Aglaroxin E
|
535.60
|
2.8
|
2
|
8
|
106.92
|
7
|
|
|
C-3'-Hydroxyrocaglamide; Roc D
|
521.60
|
2.5
|
3
|
8
|
117.92
|
6
|
|
|
2-[(4bS,8aR)-10-acetyloxy-1-hydroxy-4b,8,8-trimethyl-3,4-dioxo-5,6,7,8a,9,10-hexahydrophenanthren-2-yl]propyl acetate
|
432.50
|
3.1
|
1
|
7
|
106.97
|
6
|
|
|
3-[2-[(1R,4aR,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-5-methoxyoxolan-2-one
|
332.50
|
5.5
|
0
|
3
|
35.53
|
3
|
|
|
methyl (12S,13R,14Z)-14-ethylidene-12-(hydroxymethyl)-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraene-12-carboxylate
|
340.40
|
1.3
|
2
|
4
|
65.56
|
3
|
|
|
(+)-Bornyl p-coumarate
|
300.40
|
4.8
|
1
|
3
|
46.53
|
4
|
|
|
(3aS,6aS,10aS)-10-hydroxy-3,6-dimethyl-9-methylidene-3a,4,5,6,6a,7,8,10-octahydro-3H-benzo[h][1]benzofuran-2-one
|
250.33
|
2.3
|
1
|
3
|
46.53
|
0
|
|
|
3-methyl-5-[4-[(2R)-2-[(2S)-4-methyl-5-oxo-2H-furan-2-yl]pyrrolidin-1-yl]butylidene]furan-2-one
|
317.40
|
2.7
|
0
|
5
|
55.84
|
5
|
|
|
(1R,4aR,5R,8aR)-1,4a-dimethyl-6-methylidene-5-(3-methylpenta-2,4-dienyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
|
302.50
|
5.7
|
1
|
2
|
37.3
|
4
|
|
|
Humulene oxide II
|
220.35
|
3.8
|
0
|
1
|
12.53
|
0
|
|
|
(3S)-5-[(1R,4aR,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol
|
290.50
|
5.7
|
1
|
1
|
20.23
|
4
|
|
|
(1S,2S,6E,10S,11S,16E)-6,16-di(butylidene)-5,15-dioxapentacyclo[9.5.2.01,13.02,10.03,7]octadeca-3(7),12-diene-4,14-dione
|
380.50
|
4.9
|
0
|
4
|
52.6
|
4
|
|
|
(3S,3'E,5'aR,6'S,7'aS)-3'-butylidene-6'-propylspiro[4,5-dihydro-2-benzofuran-3,7'-5,5a,6,7a-tetrahydro-4H-cyclobuta[g][2]benzofuran]-1,1'-dione
|
380.50
|
4.5
|
0
|
4
|
52.6
|
4
|
|
|
6-(Hydroxymethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one
|
204.26
|
2.1
|
1
|
2
|
37.3
|
1
|
|
|
[(4aR,7R,7aR)-6-acetyloxy-4a-hydroxy-1-(3-methylbutanoyloxy)spiro[1,5,6,7a-tetrahydrocyclopenta[c]pyran-7,2'-oxirane]-4-yl]methyl 3-methyl-2-(3-methylbutanoyloxy)butanoate
|
540.60
|
2.5
|
1
|
11
|
147.19
|
15
|
|
|
Nonin A
|
300.30
|
3.1
|
2
|
5
|
75.99
|
3
|
|
|
5,7-Dihydroxy-6-(4-hydroxy-3-methylbut-2-enyl)-2-methylchromen-4-one
|
276.28
|
2.4
|
3
|
5
|
90.9
|
3
|
|
|
trans-Norpterosin C pound>>trans-NorpterosinC
|
220.26
|
1
|
2
|
3
|
57.53
|
1
|
|
|
Desacetoxyvindorosine
|
369.50
|
2.8
|
2
|
4
|
54.21
|
3
|
|
|
Eutypine
|
186.21
|
2.8
|
1
|
2
|
37.3
|
3
|
|
|
Cycloheptanol, 2-chloro-, trans-
|
148.63
|
2
|
1
|
1
|
20.23
|
0
|
|
|
8-Methoxy-2,2-dimethylchromene
|
190.24
|
2.8
|
0
|
2
|
18.46
|
1
|
|
|
5-hydroxy-2-(4-hydroxyphenyl)-6-methoxy-7-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
462.40
|
0.8
|
6
|
11
|
179.28
|
5
|
|
|
(2R)-7-hydroxy-2-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
|
392.50
|
6
|
2
|
4
|
66.76
|
5
|
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