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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
Fenchone
152.23
2.3
0
1
17.07
0
(2Z,4E)-5-[(1S,5S,8S)-8-hydroxy-1,5-dimethyl-3-oxo-6-oxabicyclo[3.2.1]octan-8-yl]-3-methylpenta-2,4-dienoic acid
280.32
0.5
2
5
83.83
3
(2E,4E)-5-[(1R,5R,8S)-8-hydroxy-1,5-dimethyl-3-oxo-6-oxabicyclo[3.2.1]octan-8-yl]-3-methylpenta-2,4-dienoic acid
280.32
0.5
2
5
83.83
3
1-[4-Methoxy-3-(3-methylbut-2-enyl)phenyl]ethanone
218.29
3.5
0
2
26.3
4
(R)-Juziphine
299.40
3
2
4
52.93
3
(1S)-juziphine
299.40
3
2
4
52.93
3
Aristolactam BIII
309.30
3.2
1
4
56.79
3
[(1R,9S,11S,12Z)-12-Ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.09,14]octadeca-2,4,6,17-tetraen-18-yl]methanol
294.40
1.8
2
3
35.5
1
Borneol7-O-[beta-D-apiofuranosyl-(1-->6)]-beta-D-glucopyranoside
448.50
-0.9
6
10
158.3
6
(2R,3S,4S,5R,6R)-2-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[[(1R,2S,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]oxy]oxane-3,4,5-triol
448.50
-0.9
6
10
158.3
6
(2R,3S,4S,5R,6R)-2-[[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[[(1R,2S,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]oxy]oxane-3,4,5-triol
448.50
-0.6
6
10
158.3
6
(1R,2R,4S,5R,8R,10S,13R,14R,17S,18R)-2,10-dihydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-23-one
472.70
6.4
2
4
66.76
0
(1R,11S)-5-methoxy-12,12-dimethyl-6-propan-2-yltricyclo[9.4.0.03,8]pentadeca-3,5,7-triene-1,4-diol
332.50
5
2
3
49.69
2
Momordicinin
438.70
7.1
0
2
26.3
0
(4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bS)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,4a,5,6,7,8,9,10,11,12,12a,14a-dodecahydro-1H-picene-3,14-dione
438.70
7.6
0
2
34.14
0
(1-Ethylpropyl)benzene
148.24
4.1
0
0
0
3
(1aR,4aS,8aR)-2,4a,8,8-tetramethyl-1a,5,6,7-tetrahydro-1H-cyclopropa[d]naphthalen-4-one
218.33
3.5
0
1
17.07
0
(1aS,2S,4aS,8aR)-2-hydroxy-2,4a,8,8-tetramethyl-1,1a,3,5,6,7-hexahydrocyclopropa[d]naphthalen-4-one
236.35
2.5
1
2
37.3
0
(8R)-8-methoxy-2,15-dioxapentacyclo[22.2.2.13,7.110,14.016,21]triaconta-1(26),3(30),4,6,10(29),11,13,16(21),17,19,24,27-dodecaene-4,5,17,18-tetrol
486.50
5.5
4
7
108.61
1
[(2R,3S,4S,5R,6S)-6-[(3aR,7R,7aR)-7-hydroxy-2,2,5,7-tetramethyl-1-oxospiro[3,7a-dihydroindene-6,1'-cyclopropane]-3a-yl]oxy-5-acetyloxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl] (Z)-3-(4-hydroxyphenyl)prop-2-enoate
600.70
1.4
4
11
169.05
9
[(2R,3S,4S,5R,6S)-6-[(3aR,7R,7aR)-7-hydroxy-2,2,5,7-tetramethyl-1-oxospiro[3,7a-dihydroindene-6,1'-cyclopropane]-3a-yl]oxy-5-acetyloxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
600.70
1.4
4
11
169.05
9
Tessaric acid
248.32
2.6
1
3
54.37
2
2-[(2R,8S,8aR)-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-2-yl]prop-2-enoic acid
234.33
3.9
1
2
37.3
2
2-[(2S,4S,4aS)-4-hydroxy-4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl]prop-2-enoic acid
250.33
2.1
2
3
57.53
2
(1S,4R,5R,6R,9R,11S,13S,14S,17R,19S,22R)-9-(2-hydroxypropan-2-yl)-4,6,13,18,18-pentamethyl-10-oxahexacyclo[12.9.0.01,22.04,13.05,11.017,22]tricosan-19-ol
458.70
7
2
3
49.69
1
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