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Chemical Library

Physicochemical properties (MW, LogP) of all entries.

Total Rows 105,909
Pages 4,237
BIMP_ID Name Mol Weight LogP HBD HBA TPSA Rotatable Bonds
8-[(2S)-2-hydroxy-3-methoxy-3-methylbutyl]-5,7-dimethoxychromen-2-one
322.40
2
1
6
78.13
6
Murrayacarpin B
236.22
1
1
5
68.9
3
5-Hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one
770.70
-2.3
11
20
317.35
9
beta-D-Glucosylisoeugenol
326.34
0
4
7
108.61
5
Rubrofusarin 6-gentiobioside
596.50
-1
8
15
238.2
7
Cassiaside B
566.50
-0.6
7
14
217.97
7
10-Hydroxy-7-methoxy-3-methyl-9-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxybenzo[g]isochromen-1-one
596.50
-0.6
8
15
238.2
7
[(4S,4aR,5S,8aR)-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-4-yl] 3-methylbut-2-enoate
330.40
5
0
4
56.51
3
methyl (2S,13S,15R,16R,18S)-13-[(1R,9R,10S,11R,12R,19R)-11-acetyloxy-12-ethyl-10-hydroxy-5-methoxy-10-methoxycarbonyl-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraen-4-yl]-18-ethyl-2-(2-oxopropyl)-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5,7,9-tetraene-13-carboxylate
865.00
3.4
2
13
163.47
12
2-(3,7-Dimethylocta-1,6-dien-3-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol
316.39
1.1
4
6
99.38
7
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1S,4S,8R,10S,11S,14S)-11-ethyl-12-oxo-7,9,13-trioxatetracyclo[6.5.1.01,10.04,14]tetradeca-2,5-diene-5-carboxylate
440.40
-1.1
4
11
161.21
5
(2R,3R)-2-[(3E)-4,8-dimethylnona-3,7-dienyl]-2,7-dimethyl-3,4-dihydrochromene-3,5-diol
344.50
5.7
2
3
49.69
6
(-)-Guaia-6,9-diene
204.35
4.3
0
0
0
1
(1S,2R,4aR,8R,8aS)-4a,8-dimethyl-2-propan-2-yl-1,2,3,4,5,6,7,8a-octahydronaphthalene-1,8-diol
240.38
3.4
2
2
40.46
1
[5-(hydroxymethyl)-3,3a,4,6a-tetrahydro-2H-cyclopenta[b]furan-4-yl]methanol
170.21
-1
2
3
49.69
2
2-Amino-4-methoxyphenol
139.15
1.2
2
3
55.48
1
(1R,4S,9S,10R,13S)-7-hydroxy-5,5,9,13-tetramethyltetracyclo[11.2.1.01,10.04,9]hexadeca-7,14-diene-6,12-dione
314.40
3.9
1
3
54.37
0
Yucalexin P8
330.40
1.8
1
4
66.9
1
Yucalexin P17
318.40
3.2
2
3
57.53
1
Yucalexin P21
304.50
4.2
2
2
40.46
1
10-Hydroxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
456.70
5.5
3
4
77.76
2
(4aS,6aR,6aS,6bR,8aR,9S,10R,12aR,14bS)-10-hydroxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
456.70
5.5
3
4
77.76
2
(3aR,4S,5E,9S,11aR)-4,9-dihydroxy-6-methyl-3,10-dimethylidene-4,7,8,9,11,11a-hexahydro-3aH-cyclodeca[b]furan-2-one
264.32
0.8
2
4
66.76
0
tatridin B
264.32
0.8
2
4
66.76
0
(3aS,4R,5E,9S,11aS)-9-hydroperoxy-4-hydroxy-6-methyl-3,10-dimethylidene-4,7,8,9,11,11a-hexahydro-3aH-cyclodeca[b]furan-2-one
280.32
0.8
2
5
75.99
1
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