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
5-[1-[(4R,6R,8aS)-6-(2-hydroxypropan-2-yl)-4,8a-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylbutyl]-2,4,6-trihydroxybenzene-1,3-dicarbaldehyde
472.60
6.2
4
6
115.06
7
8-(2,4-Dihydroxyphenyl)-5-hydroxy-2,2-dimethyl-7-(2-methylprop-2-enoyl)pyrano[3,2-g]chromen-6-one
420.40
4.4
3
7
117.2
3
(1S,4aS,5R,7aS)-5-butoxy-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
446.40
-2
6
11
175.37
9
(2R)-4,5-dimethyl-2-[(1S)-1-[(5R,6R,8R,9S,10R,13R,14S,15S)-5,6,14-trihydroxy-15-methoxy-10,13-dimethyl-1-oxo-4,6,7,8,9,11,12,15-octahydrocyclopenta[a]phenanthren-17-yl]ethyl]-2,3-dihydropyran-6-one
500.60
1.9
3
7
113.29
3
(2R,6R)-6-[(1S,3R,6R,8R,11S,12S,15R,16R)-6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-2-methyl-3-methylideneheptanoic acid
470.70
9.2
2
3
57.53
6
[(1S,2R,3R,3aS,4R,4aS,4bS,6R,8S,8aS,9aR,10R,10aR)-3,4,8,8a,10-pentaacetyloxy-3a,6-dihydroxy-2,4a,6,9a-tetramethyl-2,3,4,4b,5,7,8,9,10,10a-decahydro-1H-cyclopenta[b]fluoren-1-yl] benzoate
716.80
3
2
14
198.26
13
[(5R,6R,8R,9S,10R,13R,14S,15S,17R)-17-[(1R)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-6,14,17-trihydroxy-5-methoxy-10,13-dimethyl-1-oxo-6,7,8,9,11,12,15,16-octahydro-4H-cyclopenta[a]phenanthren-15-yl] acetate
560.70
2.1
3
9
139.59
5
[(1S,2R,5S,7S,9R,11R,12S,13S,14S,16R,17S)-16-[(1R)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-12-hydroxy-5-methoxy-2,17-dimethyl-3-oxo-8,15-dioxahexacyclo[9.8.0.02,7.07,9.012,17.014,16]nonadecan-13-yl] acetate
558.70
2
1
9
124.19
5
CID 134153301
570.70
6.2
0
6
78.9
6
[(1S,2R,3S,4R,5S,7R,8S,9R,10R,11S,12S,14R,15R)-2,7,8,12-tetraacetyloxy-5-hydroxy-5,9,12-trimethyl-16-oxo-4-propanoyloxy-18-oxapentacyclo[7.7.2.01,10.03,7.011,14]octadecan-15-yl] 2-methylbutanoate
722.80
1.7
1
15
204.33
15
[(1S,2R,4R,6S,7S,8R,9R,12R)-9-benzoyloxy-2,4,12-trihydroxy-2,6,14,14-tetramethyl-10-methylidene-3,13-dioxo-7-tricyclo[10.3.0.04,8]pentadecanyl] benzoate
590.70
3.8
3
9
147.43
6
[(3R,5R,6R,8R,9S,10R,13R,14S,15S)-17-[(1S)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-3,5,6,14-tetrahydroxy-10,13-dimethyl-1-oxo-2,3,4,6,7,8,9,11,12,15-decahydrocyclopenta[a]phenanthren-15-yl] acetate
546.60
0.8
4
9
150.59
4
Methyl (3I(2),25R)-3-hydroxy-24-methylene-9,19-cyclolanostan-26-oate
484.80
9.5
1
3
46.53
7
[(3S,7S,8R,9S,10S,13R,14S,17R)-17-[(E,2R)-6-hydroxy-6-methylhept-4-en-2-yl]-7-methoxy-4,4,9,13,14-pentamethyl-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] benzoate
576.80
9
1
4
55.76
8
methyl (2R,6R)-2-methyl-3-methylidene-6-[(1S,3R,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-6-oxo-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]heptanoate
482.70
9.2
0
3
43.37
7
[(1S,2R,3S,4R,5S,7R,8S,9R,10R,11S,12S,14R,15R)-2,7,8,12-tetraacetyloxy-5,9,12-trimethyl-4,15-bis(2-methylpropanoyloxy)-16-oxo-18-oxapentacyclo[7.7.2.01,10.03,7.011,14]octadecan-5-yl] pyridine-3-carboxylate
827.90
3.1
0
17
223.29
17
7-Methoxyphenanthrene-2,4,5-triol
256.25
3.3
3
4
69.92
1
[(1S,2S,3aR,4R,4aS,4bS,8aS,9aR,10R,10aR)-4,8a,10-triacetyloxy-9a-(acetyloxymethyl)-3a-hydroxy-2,4a,6-trimethyl-8-oxo-2,3,4,4b,5,9,10,10a-octahydro-1H-cyclopenta[b]fluoren-1-yl] benzoate
654.70
3
1
12
168.8
12
[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aR,5S,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
1237.40
-1.8
16
27
433.05
14
[(1S,2R,3R,3aS,5S,6E,9S,10S,11S,13R,13aR)-1,3,9,10,11-pentaacetyloxy-3a-hydroxy-2,5,8,8-tetramethyl-12-methylidene-4-oxo-2,3,5,9,10,11,13,13a-octahydro-1H-cyclopenta[12]annulen-13-yl] benzoate
714.80
3.7
1
14
195.1
13
(1R,4S,5R,13R,14R,15S,17R,18R)-18-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-14,15-dihydroxy-5,18-dimethyl-19,21-dioxapentacyclo[12.6.1.01,17.04,13.05,10]henicosa-7,10-diene-6,20-dione
498.60
1.8
2
8
119.36
1
[(1S,2R,3R,4S,5S,7R,8R,9R,10R,11S,12S,14R,15R)-2,8,12-triacetyloxy-7-hydroxy-5,9,12-trimethyl-16-oxo-4-propanoyloxy-18-oxapentacyclo[7.7.2.01,10.03,7.011,14]octadecan-15-yl] benzoate
684.70
2.6
1
13
178.03
12
[(1S,2S,3aR,4R,4aS,4bS,8aS,9aR,10R,10aR)-4,8a,10-triacetyloxy-3a-hydroxy-2,4a,6,9a-tetramethyl-8-oxo-2,3,4,4b,5,9,10,10a-octahydro-1H-cyclopenta[b]fluoren-1-yl] benzoate
596.70
3.7
1
10
142.5
9
[(1S,2R,3R,4S,5S,7R,8S,9R,10R,11S,12S,14R,15R)-2,7,8,12,15-pentaacetyloxy-5,9,12-trimethyl-16-oxo-18-oxapentacyclo[7.7.2.01,10.03,7.011,14]octadecan-4-yl] 2-methylpropanoate
678.70
2.1
0
14
184.1
13
leuconodine E
312.40
1.7
1
3
43.78
1
Jump to page: