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
(2S,3R,4S,5S,6R)-2-[[(3S,5R,8R,9R,10R,12R,13R,14S,17S)-12-hydroxy-14-(hydroxymethyl)-17-[(2S,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-4,4,8,10-tetramethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
654.90
2.9
7
10
169.3
6
(E)-1-[3-[(2S)-2,3-dihydroxy-3-methylbutyl]-2,4-dihydroxy-6-methoxyphenyl]-3-(4-methylphenyl)prop-2-en-1-one
386.40
3.4
4
6
107.22
7
(7-Methoxy-2,2-dimethylchromen-6-yl) 2-methylbut-2-enoate
288.34
3.8
0
4
44.76
4
methyl (1'R,2'R,3S,9'R,11'R)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.02,7]tridec-6-ene]-1'-carboxylate
456.50
2.5
1
7
106.97
2
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(1S,3R,4R,5R)-4-methyl-1-propan-2-yl-3-bicyclo[3.1.0]hexanyl]oxy]oxane-3,4,5-triol
316.39
1
4
6
99.38
4
16-Hydroxy-4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,4,7,9(17),13,15-hexaene-3,6-dione
339.30
2.7
1
6
76.07
2
2-[(1R)-1,2-dihydroxyethyl]-7-methoxy-5-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
412.40
-2.1
6
10
170.05
5
[(4aS,5R,6aR,7S,11aR,11bS)-4a-hydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] acetate
360.50
4.3
1
4
59.67
2
[(4aR,5R,6aS,7S,11aS,11bR)-4a-hydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl] acetate
360.50
4.3
1
4
59.67
2
(3S,3aR,7S,8aR)-6-[(1R,3R)-1-hydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-3,7-dimethyl-3,3a,4,7,8,8a-hexahydrocyclohepta[b]furan-2-one
430.50
-0.2
5
9
145.91
6
[(1S,2S,4R,5S,6S,9S,10S,11R,13R,14R,15R,18S,20R)-4-acetyloxy-6-(furan-3-yl)-11,15,18-trihydroxy-5,10,14-trimethyl-3,8-dioxo-16-oxapentacyclo[12.3.3.01,13.02,10.05,9]icosan-20-yl] acetate
574.60
0.5
3
11
169.8
5
4-[(3S,5R,8R,9S,10S,13R,14S,16S,17S)-3-[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-14,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
780.90
2
6
14
203.06
7
[3,6,7-Trimethoxy-4-oxo-2-(3,4,5-trimethoxyphenyl)chromen-5-yl] acetate
460.40
3
0
10
111.89
9
[(1R,19R,21S,22S,23S)-6,7,8,11,12,13,22-heptahydroxy-3,16-dioxo-21-(3,4,5-trihydroxybenzoyl)oxy-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4,6,8,10,12,14-hexaen-23-yl] (1R)-7,8,9-trihydroxy-3,5-dioxo-1,2-dihydrocyclopenta[c]isochromene-1-carboxylate
908.60
0.4
13
25
424.7
6
Methyl 2-methyl-5-(4-propan-2-ylphenyl)pent-2-enoate
246.34
4.3
0
2
26.3
6
[(1S,2R,3R,4S,5S,6S,8R,9R,10R,13S,16S,17R,18R)-11-ethyl-4,16,18-trihydroxy-6-methoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-8-yl] acetate
465.60
0
3
8
108.69
6
(2R,3R,4S,5S,6R)-2-[(3S,5S,6E,9E)-3,11-dihydroxy-3,7,11-trimethyldodeca-1,6,9-trien-5-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
416.50
0.3
6
8
139.84
10
5-[(2S,3S,4S,5S)-5-(1,3-dihydro-2-benzofuran-5-yl)-3,4-dimethyloxolan-2-yl]-1,3-dihydro-2-benzofuran
336.40
2.9
0
3
27.69
2
(2S,3R,4S,5R)-2-[[(1R,2R,3S,4S,7R,9S,12R,14S,17R,18R,19R,21R)-2-hydroxy-21-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol
620.80
3.5
5
9
138.07
3
(3aS,5aR,9bS)-3a-hydroxy-5a,9-dimethyl-3-methylidene-4,5,6,7,8,9b-hexahydrobenzo[g][1]benzofuran-2-one
248.32
1.8
1
3
46.53
0
12,16,17,18-Tetrahydroyohimban
272.30
3.2
0
2
15.6
0
[(1S,3R,6R,8R,12S,13R,15R,16R,17R)-15-[(2R)-4-[(2R)-3,3-dimethyloxiran-2-yl]-4-oxobutan-2-yl]-13-hydroxy-7,7,12,16-tetramethyl-14-oxo-6-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-17-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-10-enyl] acetate
674.80
2
4
11
172.35
8
(3R)-3-butyl-7-(2,4-dihydroxy-6-pentylphenoxy)-3,5-dimethoxy-2-benzofuran-1-one
444.50
6.2
2
7
94.45
11
(6S,10E,14S)-14-hydroxy-2,6,10,14-tetramethylhexadeca-2,10,15-trien-5-one
306.50
5.3
1
2
37.3
11
methyl 7-acetyloxy-1-[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-7-methyl-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate
594.60
-2.7
7
16
240.36
10
Jump to page: