BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi

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
euphoscopin C
644.70
6.5
0
9
122.27
10
[(1S,2R,3aR,4R,5R,6E,12E,13aS)-3a,4-diacetyloxy-2,5,8,8,12-pentamethyl-9,11-dioxo-1,2,3,4,5,13a-hexahydrocyclopenta[12]annulen-1-yl] benzoate
538.60
5.3
0
8
113.04
7
[(1S,2R,3aR,4R,5S,6E,12E,13aS)-3a,4-diacetyloxy-2,5,8,8,12-pentamethyl-9,11-dioxo-1,2,3,4,5,13a-hexahydrocyclopenta[12]annulen-1-yl] benzoate
538.60
5.3
0
8
113.04
7
[(1S,2R,3aR,5R,6E,11R,12E,13aS)-3a-acetyloxy-11-hydroxy-2,5,8,8,12-pentamethyl-4,9-dioxo-2,3,5,10,11,13a-hexahydro-1H-cyclopenta[12]annulen-1-yl] benzoate
496.60
4
1
7
106.97
5
[(1S,2R,3aR,5R,6E,11R,12E,13aS)-3a,11-diacetyloxy-2,5,8,8,12-pentamethyl-4,9-dioxo-2,3,5,10,11,13a-hexahydro-1H-cyclopenta[12]annulen-1-yl] benzoate
538.60
4.6
0
8
113.04
7
[(1S,2R,3aR,4R,5R,6E,11R,12E,13aS)-4-acetyloxy-3a,11-dihydroxy-2,5,8,8,12-pentamethyl-9-oxo-1,2,3,4,5,10,11,13a-octahydrocyclopenta[12]annulen-1-yl] benzoate
498.60
3.7
2
7
110.13
5
[(1S,2R,3aR,4R,5R,6E,11R,12E,13aS)-3a-acetyloxy-4,11-dihydroxy-2,5,8,8,12-pentamethyl-9-oxo-1,2,3,4,5,10,11,13a-octahydrocyclopenta[12]annulen-1-yl] benzoate
498.60
3.7
2
7
110.13
5
[(1S,2R,3aR,5E,11R,12E,13aS)-3a-acetyloxy-11-hydroxy-2,5,8,8,12-pentamethyl-4,9-dioxo-2,3,7,10,11,13a-hexahydro-1H-cyclopenta[12]annulen-1-yl] benzoate
496.60
3.9
1
7
106.97
5
[(1S,2S,3aE,5S,6E,9R,11R,12E,13aR)-4,9,11-triacetyloxy-2,5,8,8,12-pentamethyl-1,2,3,5,9,10,11,13a-octahydrocyclopenta[12]annulen-1-yl] benzoate
566.70
5.7
0
8
105.2
9
5a-methyl-3-methylidene-2-oxo-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5,6,7,8,9,9a,9b-octahydro-3aH-benzo[g][1]benzofuran-9-carbaldehyde
426.50
-0.2
4
9
142.75
4
(3aS,5aR,6R,9R,9aS,9bS)-5a-methyl-3-methylidene-2-oxo-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5,6,7,8,9,9a,9b-octahydro-3aH-benzo[g][1]benzofuran-9-carbaldehyde
426.50
-0.2
4
9
142.75
4
9-(hydroxymethyl)-5a-methyl-3-methylidene-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5,6,7,8,9,9a,9b-octahydro-3aH-benzo[g][1]benzofuran-2-one
428.50
-0.1
5
9
145.91
4
(3aS,5aR,6R,9R,9aS,9bS)-9-(hydroxymethyl)-5a-methyl-3-methylidene-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5,6,7,8,9,9a,9b-octahydro-3aH-benzo[g][1]benzofuran-2-one
428.50
-0.1
5
9
145.91
4
3,5a-Dimethyl-2-oxo-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,3a,4,5,6,7,8,9,9a,9b-decahydrobenzo[g][1]benzofuran-9-carbaldehyde
428.50
-0.1
4
9
142.75
4
9-(Hydroxymethyl)-3,5a-dimethyl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,3a,4,5,6,7,8,9,9a,9b-decahydrobenzo[g][1]benzofuran-2-one
430.50
0
5
9
145.91
4
(3S,3aS,5aR,6R,9R,9aS,9bS)-9-(hydroxymethyl)-3,5a-dimethyl-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,3a,4,5,6,7,8,9,9a,9b-decahydrobenzo[g][1]benzofuran-2-one
430.50
0
5
9
145.91
4
6-Hydroxy-3,5a-dimethyl-9-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,3a,4,5,6,7,8,9,9a,9b-decahydrobenzo[g][1]benzofuran-2-one
430.50
0
5
9
145.91
4
(3S,3aS,5aR,6R,9R,9aS,9bS)-6-hydroxy-3,5a-dimethyl-9-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,3a,4,5,6,7,8,9,9a,9b-decahydrobenzo[g][1]benzofuran-2-one
430.50
0
5
9
145.91
4
Icariside B1
386.40
-1.6
5
8
136.68
4
(E)-4-[4-hydroxy-2,6,6-trimethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexen-1-yl]but-3-en-2-one
386.40
-1.1
5
8
136.68
5
(E)-4-[3-hydroxy-2,6,6-trimethyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexen-1-yl]but-3-en-2-one
386.40
-1.1
5
8
136.68
5
Hedyotisol B
810.80
2.6
6
16
213.68
18
4-(3-Hydroxy-but-1-enyl)-3,5,5-trimethylcyclohex-3-ene-1,2-diol
226.31
0.5
3
3
60.69
2
[(1S,2R,4S,5R,6S,7R,8R,9R,12R)-4,5,8,12-tetraacetyloxy-6-(hydroxymethyl)-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] benzoate
590.60
2.2
1
12
160.96
12
[(1S,2R,4S,5R,6S,7R,9R,12R)-4,5,12-triacetyloxy-6-(hydroxymethyl)-2,10,10-trimethyl-8-oxo-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] benzoate
546.60
1.7
1
11
151.73
10
Jump to page: