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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
(1R,12R)-15-methoxy-20-methyl-5,7-dioxa-20-azapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaen-14-ol
325.40
2.8
1
5
51.16
1
(1R,12R)-23,23-dimethyl-5,7,16,18-tetraoxa-23-azoniahexacyclo[10.10.1.02,10.04,8.013,21.015,19]tricosa-2,4(8),9,13,15(19),20-hexaene
338.40
3
0
4
36.92
0
(1S,14S)-9,20,25-trimethoxy-15,15,30-trimethyl-7,23-dioxa-30-aza-15-azoniaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-21-ol
623.80
6.1
1
7
69.62
3
(1S,14S)-9,20,21,25-tetramethoxy-15,15,30-trimethyl-7,23-dioxa-30-aza-15-azoniaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaene
637.80
6.4
0
7
58.62
4
7-Hydroxy-5-methoxy-6,8-dimethylflavone
296.30
3.5
1
4
59.67
2
(3S,5S,8R,9S,10S,13R,14S,17R)-17-[(2R,3E,5S)-5-ethyl-6-methylhepta-3,6-dien-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
412.70
9.5
1
1
20.23
5
[(3S,5S,9R,10S,13R,14R,17R)-17-[(2R,5S)-5-ethyl-6-methylhept-6-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
454.70
9.6
0
2
26.3
8
Gallagic acid
638.40
1.3
12
18
337.32
4
[(1R,12R,13R,14R)-19,20-dimethoxy-13,14-dimethyl-18-oxo-3,6,8-trioxapentacyclo[9.9.1.01,16.04,21.05,9]henicosa-4(21),5(9),10,16,19-pentaen-12-yl] (Z)-2-methylbut-2-enoate
482.50
4.1
0
8
89.52
5
[(1S,12R,13R,14R)-19,20-dimethoxy-13,14-dimethyl-18-oxo-3,6,8-trioxapentacyclo[9.9.1.01,16.04,21.05,9]henicosa-4(21),5(9),10,16,19-pentaen-12-yl] (Z)-2-methylbut-2-enoate
482.50
4.1
0
8
89.52
5
Pterosin D
248.32
1.8
2
3
57.53
2
8-Hydroxy-1,2,3-trimethoxyxanthen-9-one
302.28
3.1
1
6
78.13
3
3,5-dihydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-enyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
516.50
2.6
7
11
190.28
6
2',4'-Dihydroxy-5,7-dimethoxyisoflavone
314.29
2.4
2
6
89.13
3
Norwogonin 5,7,8-trimethyl ether
312.30
3.1
0
5
57.9
4
8-Acetoxypinoresinol 4-glucoside
578.60
0
5
13
182.83
9
8-Hydroxypinoresinol-acetat
578.60
0
5
13
182.83
9
8-Hydroxypinoresinol 4-glucoside
536.50
-0.6
6
12
176.76
7
(2S,3R,4S,5S,6R)-2-[4-[(3R,3aS,6S,6aR)-3a-hydroxy-6-(4-hydroxy-3-methoxyphenyl)-3,4,6,6a-tetrahydro-1H-furo[3,4-c]furan-3-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
536.50
-0.6
6
12
176.76
7
10-Hydroxyligstroside
540.50
-1.3
6
13
201.67
12
(2,16-Dihydroxy-5,5,9-trimethyl-14-methylidene-12,15-dioxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate
390.50
1.4
2
6
100.9
2
Pseurata C
390.50
1.4
2
6
100.9
2
[(3S,4aR,6aR,6aS,8aR,12aR,14aR,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
572.90
11.6
1
3
46.53
4
Xestoaminol C
229.40
4.7
2
2
46.25
11
(1S,4S,5E,8R,9E,11S)-4,8-dimethyl-14-methylidene-11-propan-2-ylcyclotetradeca-5,9-diene-1,4,8-triol
322.50
3.2
3
3
60.69
1
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