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
(2R,3R)-2-(3,4-dihydroxyphenyl)-3-(hydroxymethyl)-2,3-dihydropyrano[2,3-g][1,4]benzodioxin-7-one
342.30
1.8
3
7
109.36
2
7-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,5,6-tetrahydroxyxanthen-9-one
396.40
5.9
4
6
111.13
5
2-[[(1R,4S,5S,8R,9R,12S,13S,16S,19S)-19-methoxy-8-[(E,2R)-6-methoxy-6-methylhept-4-en-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-2-en-16-yl]oxy]-2-oxoacetic acid
572.80
7.3
1
7
91.29
9
[(1S,2S)-2-[(1R,3S,7R,10S,13R,15R,16S,18R)-2,15-dihydroxy-9,9,18-trimethyl-5,14-dioxo-4,8,21-trioxahexacyclo[13.5.1.01,13.03,7.03,10.016,18]henicosan-17-yl]-1-[(2S)-4-methyl-5-oxooxolan-2-yl]propyl] acetate
590.70
1.5
2
11
154.89
5
(1S,2R,7S,9R,11R,12R,15S,16S)-15-[(2S,3R)-2,3-dihydroxy-4-[(3S,4R)-4-methyl-5-oxooxolan-3-yl]butan-2-yl]-12,15-dihydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-3-one
504.60
1.7
4
8
136.82
4
(1S,5R,7S,8aS)-1-methyl-4-methylidene-7-prop-1-en-2-yl-2,5,6,7,8,8a-hexahydro-1H-azulen-5-ol
218.33
3.3
1
1
20.23
1
(10E)-17-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2R,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxytricyclo[12.3.1.12,6]nonadeca-1(17),2,4,6(19),10,14(18),15-heptaen-9-one
588.60
0.1
7
12
195.6
5
[(1S,3bR,4R,5aR,10aR,10bR,11R,12aS)-4-hydroxy-1-[(2R,3S,5R)-5-[(1S)-1-hydroxy-2-methoxy-2-methylpropyl]-2-methoxyoxolan-3-yl]-3b,6,6,10a,12a-pentamethyl-8-oxo-1,2,4,5,5a,10b,11,12-octahydroindeno[5,4-g][2]benzoxepin-11-yl] (E)-2-methylbut-2-enoate
644.80
5
2
9
120.75
8
(2S,3S)-3-(3,4-dihydroxyphenyl)-2-(hydroxymethyl)-2,3-dihydropyrano[3,2-g][1,4]benzodioxin-7-one
342.30
1.8
3
7
109.36
2
(+/-)-9-Hydroxy-5-oxo-2,3,4,5-tetrahydro-1h-benzo[b]azepine-2-carboxamide
220.22
0.4
3
4
92.42
1
(10S,11R,12R,13S,15R)-13-[2-[3-(3,4-dihydroxyphenyl)propanoyl]-3,5-dihydroxyphenoxy]-3,4,5,11,12,21,22,23-octahydroxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione
754.60
2
12
19
330.89
6
[(1S,2S,4R,5R,8R,10S,11R,13R,15R)-1-hydroxy-4,8,12,12,15-pentamethyl-9-oxo-5-tetracyclo[8.5.0.02,6.011,13]pentadec-6-enyl] acetate
360.50
3
1
4
63.6
2
2-[(2R,3R,3aR,5aR,6E,9aS,9bS)-3-[(E,2R)-6-acetyloxy-2-hydroxy-6-methyl-3-oxohept-4-en-2-yl]-6-(carboxymethylidene)-2-hydroxy-3a,5a,9b-trimethyl-5-oxo-1,2,3,4,9,9a-hexahydrocyclopenta[a]naphthalen-7-yl]-2-methylpropanoic acid
588.70
2.4
4
10
175.5
9
(1S,2R,5R,7S,10R,12S,15R,16R,17S,18R,21R,22R,24R,25R)-1,6,6,15,17,20,20-heptamethyl-7-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosane-21,22,25-triol
636.80
2.7
6
10
158.3
2
[(1R,5S,6R)-3-(hydroxymethyl)-5-[(Z)-2-methylbut-2-enoyl]oxy-4-oxo-6-propan-2-ylcyclohex-2-en-1-yl] (Z)-2-methylbut-2-enoate
364.40
3.7
1
6
89.9
8
4-(1,7-Diazatricyclo[7.3.1.05,13]trideca-5(13),6,8-trien-6-yl)-1-piperidin-1-ylbutan-1-one
327.50
2.7
0
3
36.44
4
(2R,3R,4S,5S,6R)-2-[(E)-3-[(2S,3R)-2-[3,5-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
712.70
-1.5
9
17
255.91
13
(2S,3S)-2-(3,4-dihydroxyphenyl)-3-(hydroxymethyl)-5-methoxy-2,3-dihydropyrano[3,2-g][1,4]benzodioxin-7-one
372.30
1.8
3
8
118.59
3
methyl (1S,10S,14S,15R,18S)-17-ethyl-10-hydroxy-14-(2-oxopropyl)-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2,4,6,8-tetraene-1-carboxylate
410.50
2.1
1
6
79.2
5
5-(Ethoxymethyl)-1-[2-(4-hydroxyphenyl)ethyl]pyrrole-2-carbaldehyde
273.33
2
1
3
51.46
7
methyl (1R,12R,13R,14S,15E)-1-[(1R,15R,17S,18S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-6-yl]-15-ethylidene-17-methyl-3-aza-17-azoniapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carboxylate
615.80
5.9
2
3
61.12
4
(3aS,5R)-3,8-dimethyl-5-prop-1-en-2-yl-4,5,6,7-tetrahydro-3aH-azulen-1-one
216.32
3.4
0
1
17.07
1
3-[[(3S,7S,8S,9R,10R,13R,14S,17R)-9-formyl-7-methoxy-17-[(2R,4S)-4-methoxy-6-methylhept-5-en-2-yl]-4,4,13,14-tetramethyl-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3-oxopropanoic acid
586.80
6.6
1
7
99.13
11
(10R,11S,12R)-10,11,12,17-tetrahydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytricyclo[12.3.1.12,6]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-9-one
506.50
-0.8
8
11
197.37
3
(1S,3aS,7R,7aS)-1-[[2-(4-hydroxyphenyl)acetyl]oxymethyl]-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,3a,6,7,7a-hexahydro-1H-indene-4-carboxylic acid
508.50
0.5
6
11
183.21
9
Jump to page: