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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
Aklavinone
412.40
2.5
4
8
141.36
3
(1R,2R,7R,10R,11S,14R,15R,16R)-16-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-7,15-dihydroxy-10,14,16-trimethyl-17-oxapentacyclo[13.2.2.01,14.02,11.05,10]nonadec-4-en-9-one
470.60
2.2
2
6
93.06
1
12-Acetoxyamoorastatin
574.60
0.7
3
11
165.26
5
[(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15S,19R,20R,21S)-4,21-diacetyloxy-6-(furan-3-yl)-12,19,20-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-16-yl] 2-methylbutanoate
674.70
1.7
3
13
191.56
9
Pristane
268.50
9.3
0
0
0
12
Thalidasine
652.80
6.4
0
9
71.09
5
(1R,2R,3S,4S,5S,8S,9S,12R)-5-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid
348.40
3.1
3
5
94.83
2
[(1R,18S,19S,21S,22S)-6,7,8,11,12,13,22-heptahydroxy-21-(hydroxymethyl)-3,16-dioxo-2,17,20-trioxatetracyclo[16.3.1.04,9.010,15]docosa-4,6,8,10,12,14-hexaen-19-yl] 3,4,5-trihydroxybenzoate
634.50
0.1
11
18
310.66
4
3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
596.50
-1.2
10
16
269.43
6
Tetrahydroharmine
216.28
1.9
2
2
37.05
1
Viridifloric acid
162.18
0.1
3
4
77.76
3
[(1S,2S,4S,5S,6R,8S,10S)-8,10-diethoxy-2-(hydroxymethyl)-3,9-dioxatricyclo[4.4.0.02,4]decan-5-yl] 4-hydroxy-3-methoxybenzoate
424.40
1.4
2
9
116.21
9
Aristololactam-glucoside
455.40
1.2
4
9
138.15
3
(2R,3S,4R,5R,6R)-2-(hydroxymethyl)-6-[[(1S,4S,5S,8R,9R,12S,13S,16S)-8-[(2R,4S)-4-methoxy-6-methylhept-5-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-en-16-yl]oxy]oxane-3,4,5-triol
632.90
5.7
4
8
117.84
8
Artemisinic alcohol
220.35
3.8
1
1
20.23
2
Stemoninine
389.50
3.4
0
6
65.07
2
Fujikinetin methyl ether
326.30
2.9
0
6
67.13
3
(4->2)-Abeo-16-hydroxycleroda-2,13-dien-15,16-olide-3-al
332.40
3.2
1
4
63.6
4
(1S,5S,6R,13R)-1,6,9,17,19-pentahydroxy-5,13-bis(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-2(11),3(8),9,15,17,19-hexaen-21-one
558.50
3.2
7
11
186.37
2
(1R,5S,6R,13S)-1,6,9,17,19-pentahydroxy-5,13-bis(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-2(11),3(8),9,15,17,19-hexaen-21-one
558.50
3.2
7
11
186.37
2
Baldrinal
218.20
1.1
0
4
56.51
4
Gracillin
885.00
1.4
9
17
255.91
8
Acetyltaurine
167.19
-1.6
2
4
91.85
3
US9138393, 3-Benzyladenine
225.25
1.7
2
4
80.48
2
(1S,12R,13S,16R,18R)-16,18-dimethyl-2,9-dioxo-17-oxapentacyclo[11.4.1.01,10.03,8.012,16]octadeca-3,5,7,10-tetraene-18-carbaldehyde
322.40
1.9
0
4
60.44
1
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