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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
CID 100919419
504.50
1.8
0
10
130.87
8
4-[(3R)-7-hydroxy-6,8-bis(3-methylbut-2-enyl)-3,4-dihydro-2H-chromen-3-yl]benzene-1,3-diol
394.50
6.5
3
4
69.92
5
(1R,2R,4R,5R,10R,11S,14R,15S,16S)-4,5-dihydroxy-16-[(2R)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]-10,14,16-trimethyl-17-oxapentacyclo[13.2.2.01,14.02,11.05,10]nonadecan-9-one
488.60
2
3
7
113.29
2
(1R,2R,7R,10R,11S,14R,15R,16R,18S)-16-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-15,18-dihydroxy-10,14,16-trimethyl-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-17-oxapentacyclo[13.2.2.01,14.02,11.05,10]nonadec-4-en-9-one
648.70
-0.3
6
12
192.44
4
Gnetinc
454.50
5.4
5
6
110.38
4
Pimolin
460.40
3.3
0
8
97.34
2
1-Sulfoquinovosylglycerol
317.29
-4.4
5
10
185.19
5
(2S,3R,4S,5S)-2-ethoxyoxane-3,4,5-triol
178.18
-1.6
3
5
79.15
2
(8E,22Z)-4-hydroxy-2-oxa-11,16,20-triazatricyclo[22.2.2.13,7]nonacosa-1(26),3,5,7(29),8,22,24,27-octaene-10,21-dione
435.50
3.1
4
5
99.69
0
1,4,5,6-Tetrahydroxy-7,8-diprenylxanthone
396.40
5.9
4
6
111.13
4
3-[[(2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxy-5-methoxyphenyl)-7-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[3-(4-hydroxyphenyl)prop-2-enoyloxymethyl]oxan-2-yl]oxychromenylium-5-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid
873.70
11
21
349.65
16
(2S,3S,4S,5R,6S)-6-[2-[4-[(2S,3R,4S,5S,6R)-6-[(2-carboxyacetyl)oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxyphenyl]-5-hydroxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
694.50
-1
9
19
309.64
11
TG(18:1(9Z)/18:2(9Z,12Z)/18:3(9Z,12Z,15Z))
879.40
20.3
0
6
78.9
50
TG(16:0/18:2(9Z,12Z)/18:3(9Z,12Z,15Z))
853.30
20.2
0
6
78.9
49
(5E,9E)-nonadeca-5,9-dienoic acid
294.50
6.9
1
2
37.3
15
(1aR,4R,4aR,7R,7aS,7bR)-1,1,4,7-tetramethyl-2,3,4,5,6,7,7a,7b-octahydro-1aH-cyclopropa[h]azulen-4a-ol
222.37
3.9
1
1
20.23
0
(3S,5S,8S,9S,10S,11R,13S,14S,16S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,11,16-triol
308.50
3
3
3
60.69
0
(5S,8S,9S,10S,11R,13S,14S,16R)-11,16-dihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
306.40
2.6
2
3
57.53
0
20R,21-Epoxyresibufogenin
400.50
3.5
1
5
71.59
1
12-Ethoxy-24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaene
377.40
4.5
0
6
49.39
2
(1S,9S)-6,11,12-Trihydroxy-5,13-dimethoxy-1,9-dimethyl-16-oxo-8,17-dioxatetracyclo[7.7.1.02,7.010,15]heptadeca-2(7),3,5,10,12,14-hexaene-3-carbaldehyde
402.40
1.4
3
9
131.75
3
(3aR,6R,6aR,9R,9aR,9bR)-6,9-dihydroxy-6a-methoxy-6,9-dimethyl-3-methylidene-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-2-one
294.34
0.4
2
5
75.99
1
(2S,3S,4S,5R,6S)-5-acetyloxy-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxochromen-7-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid
504.40
1.3
6
13
213.42
6
(1R,5R,7R,8S)-4-hydroxy-8-methyl-1-(2-methylbutanoyl)-3,5,7-tris(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)bicyclo[3.3.1]non-3-ene-2,9-dione
550.80
10
1
4
71.44
12
methyl (13R,15R,17S)-17-ethyl-17-hydroxy-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraene-13-carboxylate
356.50
2.8
2
4
65.56
3
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