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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
1,2,10,15,19,19-Hexamethyl-7-propan-2-yl-6-oxahexacyclo[12.8.0.02,11.05,7.05,10.015,20]docosane
426.70
9.6
0
1
12.53
1
2,5-Dimethyl-5-(4-methylpent-3-enyl)-3,4,4a,6,7,8-hexahydronaphthalene-1,8a-dicarbaldehyde
302.50
4.6
0
2
34.14
5
(4aS,5S,8aR)-2,5-dimethyl-5-(4-methylpent-3-enyl)-3,4,4a,6,7,8-hexahydronaphthalene-1,8a-dicarbaldehyde
302.50
4.6
0
2
34.14
5
(1R,4aS,5R,8aS)-3-methyl-8-methylidene-5-propan-2-yl-2,4a,5,6,7,8a-hexahydro-1H-naphthalen-1-ol
220.35
3.2
1
1
20.23
1
1a-Methyl-4-methylidene-7-propan-2-yl-2,3,3a,5,6,7,7a,7b-octahydronaphtho[1,2-b]oxiren-3-ol
236.35
2.6
1
2
32.76
1
(1aS,3R,3aS,7R,7aR,7bR)-1a-methyl-4-methylidene-7-propan-2-yl-2,3,3a,5,6,7,7a,7b-octahydronaphtho[1,2-b]oxiren-3-ol
236.35
2.6
1
2
32.76
1
(1S,4R,4aR,6R,8aS)-1,6-dimethyl-4-propan-2-yl-2,3,4,4a,5,7,8,8a-octahydronaphthalene-1,6-diol
240.38
2.8
2
2
40.46
1
(1R,4aS,5R,7S,8aS)-3-methyl-8-methylidene-5-propan-2-yl-2,4a,5,6,7,8a-hexahydro-1H-naphthalene-1,7-diol
236.35
1.9
2
2
40.46
1
(1R,4aS,5R,8S,8aR)-3,8-dimethyl-5-propan-2-yl-2,4a,5,6,7,8a-hexahydro-1H-naphthalene-1,8-diol
238.37
2.4
2
2
40.46
1
Maltoxazine
179.22
0.5
0
3
29.54
0
6-(12-Ethyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6-trien-8-yl)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-one
442.50
2.5
3
7
93.47
3
Deethyaconitine
617.70
-0.6
4
12
162.24
10
Tiliarine
562.70
5.8
1
7
63.63
2
beta-D-Galactopyranoside, (3beta,5alpha,22beta,25S)-spirosolan-3-yl O-beta-D-glucopyranosyl-(1-2)-O-beta-D-glucopyranosyl-(1-4)-
902.10
0.9
11
18
278.94
9
(3R,3aR,7S,8aR)-3,7-dihydroxy-6,8a-dimethyl-3-propan-2-yl-2,3a,7,8-tetrahydro-1H-azulen-4-one
252.35
1.4
2
3
57.53
1
Nimbocinol
408.50
4.3
1
4
67.51
1
[6-hydroxy-17-(2-hydroxy-5-oxo-2H-furan-4-yl)-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-7-yl] acetate
484.60
3.4
2
7
110.13
3
[7-acetyloxy-12-hydroxy-17-(2-hydroxy-5-oxo-2H-furan-3-yl)-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-11-yl] 2-hydroxy-2-methylpropanoate
586.70
2.1
3
10
156.66
6
[(5R,7R,8R,9R,10S,11S,12R,13S,17R)-7-acetyloxy-12-hydroxy-17-(2-hydroxy-5-oxo-2H-furan-4-yl)-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-11-yl] 2-hydroxy-2-methylpropanoate
586.70
2.6
3
10
156.66
6
methyl 2-[6-(2-hydroxy-5-oxo-2H-furan-4-yl)-7,9,11,15-tetramethyl-14-oxo-3,17-dioxapentacyclo[9.6.1.02,9.04,8.015,18]octadeca-7,12-dien-10-yl]acetate
484.50
1.1
1
8
108.36
4
(1R,2R,4R,6S,9S,10S,13S,16R)-2,6,16-trihydroxy-9-(hydroxymethyl)-5,5-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-15-one
350.40
0.8
4
5
97.99
1
(1S,2S,5S,8R,9R,11S,13R,18R)-9,13,18-trihydroxy-12,12-dimethyl-6-methylidene-14-oxapentacyclo[11.2.2.15,8.01,11.02,8]octadecan-7-one
348.40
1.1
3
5
86.99
0
Spirosta-3,5-diene
396.60
6.9
0
2
18.46
0
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-10-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
588.80
6
4
7
116.45
3
Saponin PE
751.00
4.4
7
12
195.6
6
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