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
Tropolone
122.12
0.5
1
2
37.3
0
(4-hydroxy-2,6-dimethoxyphenyl)-[3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methanone
436.40
0.4
5
10
155.14
7
7-Hydroxy-6-(2-hydroxy-3-methylbut-3-enyl)-3-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-enyl)chromen-4-one
436.50
5.2
3
6
100.13
7
5alpha,8alpha-Epidioxysterol
442.70
7.2
1
3
38.69
4
(1R,3aR,5aR,5bR,7S,7aR,9S,11aR,11bR,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-7,9-diol
442.70
8.5
2
2
40.46
1
(1R,2R,5R,8R,9R,12R,13R,16S)-8-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-9,13-dimethyl-18,19-dioxapentacyclo[10.5.2.01,13.04,12.05,9]nonadec-3-ene-2,16-diol
444.60
5.2
2
4
58.92
4
Catechin 7-O-beta-D-glucopyranoside
452.40
-1.4
8
11
189.53
4
Lucidadiol
456.70
6.7
2
3
57.53
5
9,10,16-Trihydroxyhexadecanoic acid
304.42
2.5
4
5
97.99
15
norquadrangularic acid A
462.60
5.2
4
6
115.06
5
(-)-Epicatechin gallate
442.40
1.5
7
10
177.14
4
20-Epikoetjapic acid
470.70
7.5
2
4
74.6
5
3-[(3S,3aS,5aS,6S,9aS,9bR)-3a,5a,9b-trimethyl-3-[(2R)-6-methylhept-5-en-2-yl]-7-propan-2-ylidene-2,3,4,5,6,8,9,9a-octahydro-1H-cyclopenta[a]naphthalen-6-yl]propyl acetate
470.80
10.3
0
2
26.3
9
(1S,4aS,7S,7aS)-7-(benzoyloxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid
480.50
0.5
5
11
172.21
8
(2Z)-2-[(3S,4S,5S,6R,10S)-4,10-dihydroxy-3-[(2E,4E)-1-hydroxy-10-methyl-6-methylideneundeca-2,4,9-trien-2-yl]-6-(3-hydroxypropyl)-10-methylspiro[4.5]decan-7-ylidene]propanal
486.70
4.2
4
5
97.99
11
1-O-methylnyasicoside
492.50
0.3
8
11
189.53
8
5,7-dihydroxy-2-[(2R,3R)-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]chromen-4-one
494.40
3.2
4
10
148.05
5
(3S)-3-hydroxy-5-[(E)-3-[3-hydroxy-5-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoxy]-3-methyl-5-oxopentanoic acid
502.50
-1.3
7
13
212.67
12
(1R,2R,4aS,6aR,6aS,6bR,8aR,10S,12aS,13R,14bS)-10-hydroxy-2-(hydroxymethyl)-13-methoxy-1,6a,6b,9,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
502.70
5.4
3
5
86.99
3
Pannellin
506.50
3.1
2
9
112.91
6
[(1S,3S,4S,6R,7S,9R,10S,11S,13S)-3,6,7-triacetyloxy-5,5,9-trimethyl-14-methylidene-15-oxo-11-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate
518.60
3.2
0
9
122.27
8
di-O-methallylmangostin
518.60
9.5
1
6
78.13
11
N-[2-(1H-indol-3-yl)ethyl]pentacosanamide
524.90
14
2
1
44.89
26
[(2R,3R)-3-(acetyloxymethyl)-4-(3,4,5-trimethoxyphenyl)-2-[(3,4,5-trimethoxyphenyl)methyl]butyl] acetate
534.60
4.3
0
10
107.98
17
3'-Hydroxydehydroaglaiastatin
540.60
2.3
2
8
112.27
5
Jump to page: