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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
Kushenol X
440.50
5.2
5
7
127.45
6
(3S,8S,9S,10R,11R,13R,14S,17R)-10,13-dimethyl-17-[(1S)-1-[(1R,2R)-2-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopropyl]ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,11-diol
442.70
7.6
2
2
40.46
4
[(2S)-2-[(1S,3Z,7E,11R,12E,15S)-11,17-dihydroxy-1,4,8,12-tetramethyl-18-oxo-16-bicyclo[13.3.0]octadeca-3,7,12,16-tetraenyl]propyl] acetate
444.60
3.5
2
5
83.83
4
(5S)-1,7-bis(4-hydroxyphenyl)-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyheptan-3-one
446.50
1.2
5
8
136.68
10
5-(6-Hydroxy-2-benzofuranyl)-4-[(2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-yl]-1,3-benzenediol
446.60
8.6
3
4
73.83
9
(2S,3S,4S)-2-[(1S,3R,6S,8R,11S,12S,15R,16R)-6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-6-methylhept-5-ene-3,4-diol
458.70
7.5
3
3
60.69
4
dl-O-Phosphoserine
185.07
-5.1
4
7
139.89
4
Pyruvic Acid
88.06
-0.3
1
3
54.37
1
[(1R,2S,4aR,6S,6aS,7R,10aR,11aS,11bS)-1-acetyloxy-4a,6,10a-trihydroxy-4,4,7,11b-tetramethyl-9-oxo-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-2-yl] acetate
466.50
0.9
3
9
139.59
4
Coagulin J
470.60
2.6
2
6
93.06
2
[(4R,4aR,5S,7R,8S,8aR)-8-[(2S,3aS,5R,6aR)-5-ethoxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-2-yl]-5-acetyloxy-7,8-dimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-4a-yl]methyl acetate
480.60
3.4
0
8
92.82
8
19alpha,24-Dihydroxyurs-12-en-3-on-28-oic acid
486.70
4.9
3
5
94.83
2
3-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
492.40
0.5
6
12
188.51
6
(2S)-2-[(2R,3R,4R)-4-hydroxy-5-oxo-3-(3,4,5-trihydroxybenzoyl)oxyoxolan-2-yl]-2-(3,4,5-trihydroxybenzoyl)oxyacetic acid
496.30
0
8
15
257.81
8
(4aS,6aS,6aS,6bR,8aS,10S,12R,12aS,14bS)-8a,10,12-trihydroxy-9,9-bis(hydroxymethyl)-6a,6b,12a-trimethyl-2-methylidene-3,4,5,6,6a,7,8,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid
504.70
2.5
6
7
138.45
3
[(1S,3R,4aS,6S,6aR,7S,10aS,10bS)-1-acetyloxy-4a,6a,7,10b-tetramethyl-2',8-dioxospiro[1,2,5,6,7,9,10,10a-octahydrobenzo[f]chromene-3,4'-oxolane]-6-yl] benzoate
512.60
3.6
0
8
105.2
5
rel-(2R,3R)-5-((E)-2-(3-(3,5-Dihydroxyphenyl)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-2,3-dihydrobenzofuran-5-yl)vinyl)benzene-1,3-diol
514.50
5.3
5
8
128.84
6
Kotalagenin 16-acetate
514.70
7
1
5
80.67
3
Methyl quadrangularate
518.70
5.8
4
6
107.22
8
Urolignoside
522.50
0.3
6
11
167.53
10
methyl N-[4-[[(5S,6R)-7,9-dibromo-6-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,7,9-triene-3-carbonyl]amino]-2-oxobutyl]carbamate
525.10
-0.3
3
8
135.55
8
[(1R,2R,3R,4R,6S,8S,9S,10S,11S,13S)-2,3,6-triacetyloxy-8-hydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-11-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate
534.60
2.2
1
10
142.5
8
(4aS,6aR,6aR,6bR,8aR,10R,12aR,14bS)-10-acetyloxy-4a-methoxycarbonyl-2,2,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-6a-carboxylic acid
542.70
6.9
1
6
89.9
5
(2R,4S,7R,8S,9S,10S,12R,13R,16R,17S,18R)-16-acetyloxy-10-hydroxy-2,9,13,17-tetramethyl-7-(4-methyl-2-oxopent-3-enyl)-6-oxo-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-1(20)-ene-17-carboxylic acid
556.70
3.9
2
8
127.2
6
Hematoxylin
302.28
1.2
5
6
110.38
0
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