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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
[(3aR,4aR,6R,7R,8aR,9aR)-7-hydroxy-8a-methyl-3,5-dimethylidene-2-oxo-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-6-yl] acetate
306.40
1.5
1
5
72.83
2
tatridin-A
264.32
0.6
2
4
66.76
0
(4aS,6aR,6aR,6bR,7R,8aR,10S,12aS,14bS)-7,10-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
472.70
6.1
3
4
77.76
1
(1R,2S,3S,4S,5R,6S,8S,9S,10R,13S,16S,17S)-11-ethyl-4,6,16-trimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-3,8,13-triol
423.50
-0.4
3
7
91.62
4
(1R,4R,5R,6R,10R,11R,16R)-5,6,11-trihydroxy-5,6-dimethyl-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadecane-3,7-dione
371.40
-0.1
3
8
116.53
1
3-[(Z)-2-(1-acetylcyclopropyl)prop-1-enyl]-5,5-dimethylcyclopent-2-en-1-one
232.32
2.3
0
2
34.14
3
CID 101297666
430.50
4.5
0
6
78.9
6
(8S,9S,10R,13S,14S,16S,17R)-17-[(3R)-2,3-dihydroxy-6-methylheptan-2-yl]-16-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
432.60
5
3
4
77.76
5
(3S,8S,9S,10R,13S,14S,16S,17R)-17-(2-hydroxy-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol
418.70
6.2
3
3
60.69
5
(6R,8S,9S,10R,13S,14S,17S)-6-hydroxy-17-(2-hydroxy-6-methylheptan-2-yl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
416.60
5.4
2
3
57.53
5
(1S,2S,3S,5S)-2-ethenyl-2-methyl-3,5-bis(prop-1-en-2-yl)cyclohexan-1-ol
220.35
4.8
1
1
20.23
3
(3S,8R,9S,10R,13R,14S,17R)-17-acetyl-3,14-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,12,16,17-decahydrocyclopenta[a]phenanthrene-11,15-dione
360.40
0.2
2
5
91.67
1
[5-ethenyl-1-oxo-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-3-yl] (E)-8-hydroxy-2,6-dimethyloct-6-enoate
542.60
1.2
5
12
181.44
12
(4S,5R)-4-hydroxy-5-(6-hydroxy-6-methylhept-1-en-2-yl)-2-methylcyclohex-2-en-1-one
252.35
1.9
2
3
57.53
5
(2R,3S,4R)-2-(3,4-dihydroxyphenyl)-6-[(2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,4,7-triol
562.50
2
9
11
200.53
3
(1S,2R,5R,6R,9R,10S,13R,14S,17R,19S,20S)-2,5,10,13,19,20-hexamethyl-6-propan-2-yl-18-oxahexacyclo[11.9.0.02,10.05,9.014,20.017,19]docosane
426.70
9.5
0
1
12.53
1
(E)-5-[(1R,4aR,5S,8aR)-5-formyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enoic acid
318.40
4.7
1
3
54.37
5
Ent-atiserene
272.50
6.9
0
0
0
0
Solidagolactone II
400.50
5.5
0
4
52.6
6
(1S,4S,5S,9S,10R,13R,14R)-5-(hydroxymethyl)-5,9,14-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecan-14-ol
306.50
4.5
2
2
40.46
1
Humuladienone
220.35
3.8
0
1
17.07
0
(2S,3R,5R,8R,9S,10R,13R,14R,17R)-17-[(2S,3R)-3,6-dihydroxy-6-methylheptan-2-yl]-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-one
466.60
2.2
5
6
118.22
5
(2S,3R,5R,8R,9S,10R,13R,14R,17R)-2,3,14-trihydroxy-17-[(2S,3R)-3-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-one
450.70
3.6
4
5
97.99
5
[(1S,2S,5R,7R,8S,9S,10S,11R,15R)-7-acetyloxy-9,15-dihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-10-yl] acetate
434.50
1.9
2
7
102.29
4
methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-(7-methoxy-1,3-benzodioxole-5-carbonyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
592.60
3.9
1
10
117.78
8
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